SCHEMBL14360222

SCHEMBL14360222

COc1ccc(C[C@@H](NC(=O)O)C(=O)N2CC(OCCCCOCc3ccccc3)(c3ccccc3C)C2)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MC1R Q01726 8/20 0.61
MC4R P32245 8/20 0.61
TACR1 P25103 2/20 0.43
L3MBTL1 Q9Y468 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
ITGB3 P05106 3/20 0.39
ITGA2B P08514 3/20 0.39
TSHR P16473 1/20 0.38
KMT2A Q03164 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
SCHEMBL16444996 0.91 MC1R (0.70) MC1RMC4RKMT2A
SCHEMBL16188227 0.91 MC1R (0.72) MC1RMC4RKMT2A
SCHEMBL14360597 0.86 MC1R (0.58) MC1RMC4RTACR1TSHRKMT2A
SCHEMBL14360419 0.85 MC1R (0.67) MC1RMC4RTACR1ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL14360092 0.85 MC1R (0.48) MC1RMC4RTACR1L3MBTL1TDP1
SCHEMBL16445574 0.85 MC1R (0.61) MC1RMC4RITGB3ITGA2BTSHR
SCHEMBL16445371 0.82 MC1R (0.62) MC1RMC4RKMT2A
SCHEMBL16444994 0.82 MC1R (0.57) MC1RMC4RTACR1KMT2A
SCHEMBL16445351 0.80 MC1R (0.73) MC1RMC4RTACR1L3MBTL1KMT2A
SCHEMBL14360593 0.79 TEAD3 (0.43) MC1RMC4RL3MBTL1TDP1KMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9981952-B2 Oxazetidine derivatives, process for preparing them and use in human medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2018-05-29 US disclosed
EP-2726478-B1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2017-01-11 EP disclosed
US-20160237065-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2016-08-18 US disclosed
US-9353083-B2 Oxazetidine derivatives, process for preparing them and use in human medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2016-05-31 US disclosed
US-20140228342-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-08-14 US disclosed
EP-2726478-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2014-05-07 EP disclosed
WO-2013001030-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-01-03 WO 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 (2 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-20160237065-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE IN HUMAN MEDICINE AND IN COSMETICS MC1R, MCHR1, MCHR2 MC1R 1/4885MC4R 31/4885TACR1 110/4885
US-20140228342-A1 OXAZETIDINE DERIVATIVES, PROCESS FOR PREPARING THEM AND USE IN HUMAN MEDICINE AND IN COSMETICS MC1R, MCHR1, MCHR2 MC1R 1/4885MC4R 33/4885TACR1 95/4885

“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.