SCHEMBL1309687

SCHEMBL1309687

COc1ccc(CC(NC(=O)NCCc2c[nH]cn2)C(=O)N2CCCCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.48
▸ CALCRL Q16602 1/20 0.42
▸ MMP1 P03956 2/20 0.42
▸ MMP3 P08254 2/20 0.42
▸ FPR2 P25090 7/20 0.41
▸ CYP51A1 Q16850 1/20 0.40
▸ MC4R P32245 1/20 0.40
▸ MC5R P33032 1/20 0.40
▸ MC3R P41968 1/20 0.40
▸ MC1R Q01726 1/20 0.40
▸ FPR1 P21462 4/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15016459 0.89 KMT2A (0.47) KMT2ACALCRLMMP1MMP3FPR2
SCHEMBL15016559 0.88 KMT2A (0.46) KMT2AMMP1MMP3FPR2CYP51A1
SCHEMBL1309039 0.88 KMT2A (0.44) KMT2ACALCRLMMP1MMP3CYP51A1
SCHEMBL1307979 0.87 KMT2A (0.49) KMT2ACALCRLMMP1MMP3CYP51A1
SCHEMBL1308536 0.87 MC4R (0.45) KMT2AMC4RMC5RMC3RMC1R
SCHEMBL1309223 0.87 MC4R (0.43) KMT2AMC4RMC5RMC3RMC1R
SCHEMBL15016416 0.87 MC4R (0.43) KMT2AMC4RMC5RMC3RMC1R
SCHEMBL1309663 0.87 MC4R (0.43) KMT2AMC4RMC5RMC3RMC1R
SCHEMBL15016490 0.87 MC4R (0.43) KMT2AMC4RMC5RMC3RMC1R
SCHEMBL3805295 0.87 MC4R (0.42) CALCRLMC4RMC5RMC3RMC1R

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2790692-B1 ASSOCIATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND OF A MC1R RECEPTOR AGONIST FOR TREATING AND/OR PREVENTING PIGMENTATION DISORDERS GALDERMA RES & DEV (FR) 2016-11-23 — — EP claimed
US-9364455-B2 Combination of a prostaglandin receptor agonist and an MC1R receptor agonist for the treatment and/or prevention of pigmentation disorders GALDERMA RESEARCH & DEVELOPMENT (FR) 2016-06-14 — — US claimed
US-20140371147-A1 COMBINATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND AN MC1R RECEPTOR AGONIST FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-12-18 — — US claimed
US-8877968-B2 Melanocortin receptor modulators, process for preparing them and use there in human medicine and cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-11-04 — — US claimed
EP-2790692-A1 COMBINATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND AN MC1R RECEPTOR AGONIST FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS Galderma Research & Development (FR) 2014-10-22 — — EP claimed
EP-2352728-B1 MELANOCORTIN RECEPTOR MODULATORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND COSMETICS GALDERMA RES & DEV (FR) 2014-05-21 — — EP claimed
WO-2013087936-A1 COMBINATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND AN MC1R RECEPTOR AGONIST FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-06-20 — — WO claimed
US-20110275657-A1 MELANOCORTIN RECEPTOR MODULATORS, PROCESS FOR PREPARING THEM AND USE THERE IN HUMAN MEDICINE AND COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-11-10 — — US claimed
EP-2790692-B1 ASSOCIATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND OF A MC1R RECEPTOR AGONIST FOR TREATING AND/OR PREVENTING PIGMENTATION DISORDERS GALDERMA RES & DEV (FR) 2016-11-23 — — EP disclosed
US-9364455-B2 Combination of a prostaglandin receptor agonist and an MC1R receptor agonist for the treatment and/or prevention of pigmentation disorders GALDERMA RESEARCH & DEVELOPMENT (FR) 2016-06-14 — — US disclosed
US-20150045719-A1 COMBINATION OF A MC1R RECEPTOR AGONIST AND UVB FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS GALDERMA RESEARCH & DEVELOPMENT (FR) 2015-02-12 — — US disclosed
EP-2825187-A1 COMBINATION OF A MC1R RECEPTOR AGONIST AND UVB FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS Galderma Research & Development (FR) 2015-01-21 — — EP disclosed
US-20140371147-A1 COMBINATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND AN MC1R RECEPTOR AGONIST FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-12-18 — — US disclosed
US-8877968-B2 Melanocortin receptor modulators, process for preparing them and use there in human medicine and cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-11-04 — — US disclosed
EP-2790692-A1 COMBINATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND AN MC1R RECEPTOR AGONIST FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS Galderma Research & Development (FR) 2014-10-22 — — EP disclosed
WO-2013135880-A1 COMBINATION OF A MC1R RECEPTOR AGONIST AND UVB FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-09-19 — — WO disclosed
WO-2013087936-A1 COMBINATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND AN MC1R RECEPTOR AGONIST FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-06-20 — — WO disclosed
US-20120301458-A1 CYCLOPROPYL MODULATORS OF P2Y12 RECEPTOR AUSPEX PHARMACEUTICALS, INC. (US) 2012-11-29 — — US disclosed
US-20110275657-A1 MELANOCORTIN RECEPTOR MODULATORS, PROCESS FOR PREPARING THEM AND USE THERE IN HUMAN MEDICINE AND COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-11-10 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140371147-A1 COMBINATION OF A PROSTAGLANDIN RECEPTOR AGONIST AND AN MC1R RECEPTOR AGONIST FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS MC1R, MC3R, MC5R KMT2A 2817/4885CALCRL 232/4885MMP1 2357/4885
US-20120301458-A1 CYCLOPROPYL MODULATORS OF P2Y12 RECEPTOR P2RY12, P2RY11, P2RY2 KMT2A 4671/4885CALCRL 361/4885MMP1 4835/4885
US-20150045719-A1 COMBINATION OF A MC1R RECEPTOR AGONIST AND UVB FOR THE TREATMENT AND/OR PREVENTION OF PIGMENTATION DISORDERS MC1R, MC3R, MC5R KMT2A 1895/4885CALCRL 120/4885MMP1 4682/4885
US-20110275657-A1 MELANOCORTIN RECEPTOR MODULATORS, PROCESS FOR PREPARING THEM AND USE THERE IN HUMAN MEDICINE AND COSMETICS MC1R, MC5R, MC3R KMT2A 2487/4885CALCRL 129/4885MMP1 4007/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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