SCHEMBL1310666

SCHEMBL1310666

CCCCOC1(c2ccccc2F)CN(C(=O)[C@@H](Cc2ccc(OC)cc2)N(C(=O)O)C(C)(C)C)C1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MC1R Q01726 8/20 0.47
MC4R P32245 7/20 0.47
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MMP3 P08254 1/20 0.33
GAA P10253 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
CTSK P43235 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
SCHEMBL1312466 0.91 MC1R (0.55) MC1RMC4RTP53MAPTALOX15
SCHEMBL1310670 0.90 MC1R (0.54) MC1RMC4RTP53MAPTALOX15
SCHEMBL1311899 0.84 MC1R (0.47) MC1RMC4RTP53
Trifluoroacetic Acid SCHEMBL1310165 0.83 MC1R (0.49) MC1RMC4R
SCHEMBL16445371 0.82 MC1R (0.62) MC1RMC4RMMP3GAAKMT2A
SCHEMBL1311665 0.81 MC1R (0.58) MC1RMC4RMAPTGAA
SCHEMBL2148982 0.80 MC1R (0.57) MC1RMC4RKMT2A
SCHEMBL1309794 0.78 MC1R (0.44) MC1RMC4RTP53MAPTALOX15
SCHEMBL1310764 0.77 MC4R (0.38) MC1RMC4RTP53MAPTMEN1
SCHEMBL1310043 0.76 MC1R (0.55) MC1RMC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871187-B2 Oxoazetidine derivatives, process for the preparation thereof and use thereon in human medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2014-10-28 US disclosed
US-20110274638-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREON IN HUMAN MEDICINE AND IN 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 (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-20110274638-A1 OXOAZETIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND USE THEREON IN HUMAN MEDICINE AND IN COSMETICS CYP2D6, CYP51A1, CYP2C19 MC1R 326/4885MC4R 1479/4885TP53 3254/4885

“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.