SCHEMBL1308271

SCHEMBL1308271

CCN(CCc1c[nH]cn1)C(=O)N[C@@](C)(Cc1ccc(OC)cc1)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 3/20 0.36
▸ PPARD Q03181 2/20 0.36
▸ PPARG P37231 1/20 0.36
▸ MMP1 P03956 2/20 0.35
▸ MMP13 P45452 2/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ ITGB3 P05106 1/20 0.35
▸ ITGA2B P08514 1/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ LPAR1 Q92633 1/20 0.34
▸ LPAR5 Q9H1C0 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ GLA P06280 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ CTSK P43235 1/20 0.32
▸ ALOX5 P09917 1/20 0.32

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
SCHEMBL1308270 1.00 PPARA (0.36) PPARAPPARDPPARGMMP1MMP13
SCHEMBL1310031 0.83 ALPL (0.40) PPARAPPARDITGB3ITGA2BKMT2A
SCHEMBL1310422 0.82 FPR2 (0.42) KMT2ALMNAMEN1GLA
SCHEMBL1308803 0.79 NPC1 (0.40) PPARAITGB3ITGA2BKMT2AMEN1
SCHEMBL1309259 0.79 KMT2A (0.45) PPARGITGB3KMT2ALPAR1
SCHEMBL3690810 0.79 KMT2A (0.45) PPARGITGB3KMT2ALPAR1
SCHEMBL2318816 0.77 GAA (0.39) PPARGKMT2ALMNAMEN1GLA
SCHEMBL1308263 0.77 GAA (0.39) PPARGKMT2ALMNAMEN1GLA
SCHEMBL1308268 0.75 HPGD (0.36) KMT2AMEN1
SCHEMBL10535719 0.69 SMN1; SMN2 (0.49) MMP1MMP13MMP9KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
EP-2352728-A1 MELANOCORTIN RECEPTOR MODULATORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND COSMETICS Galderma Research & Development (FR) 2011-08-10 — — EP 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 (1 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-20110275657-A1 MELANOCORTIN RECEPTOR MODULATORS, PROCESS FOR PREPARING THEM AND USE THERE IN HUMAN MEDICINE AND COSMETICS MC1R, MC5R, MC3R PPARA 270/4885PPARD 262/4885PPARG 168/4885

“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.

Send feedback