SCHEMBL1312466

SCHEMBL1312466

CCCCOC1(c2ccccc2C)CN(C(=O)[C@@H](Cc2ccc(OC)cc2)N(C(=O)O)C(C)(C)C)C1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MC1R Q01726 8/20 0.55
MC4R P32245 8/20 0.55
APP P05067 1/20 0.35
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
PTGES O14684 1/20 0.34
ALOX5 P09917 1/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
MMP3 P08254 1/20 0.33
CACNA1G O43497 1/20 0.33
CTSK P43235 1/20 0.33

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
SCHEMBL1310670 0.98 MC1R (0.54) MC1RMC4RAPPTP53MAPT
SCHEMBL1311899 0.93 MC1R (0.47) MC1RMC4RTP53PTGESALOX5
SCHEMBL1310666 0.91 MC1R (0.47) MC1RMC4RTP53MAPTALOX15
SCHEMBL1311665 0.88 MC1R (0.58) MC1RMC4RAPPMAPT
SCHEMBL1309794 0.87 MC1R (0.44) MC1RMC4RAPPTP53MAPT
SCHEMBL1310043 0.85 MC1R (0.55) MC1RMC4RAPPCACNA1G
SCHEMBL16188227 0.82 MC1R (0.72) MC1RMC4RMMP3
Hydrochloric Acid SCHEMBL1310496 0.82 MC1R (0.60) MC1RMC4RAPP
Hydrochloric Acid SCHEMBL1310494 0.82 MC1R (0.60) MC1RMC4RAPP
Trifluoroacetic Acid SCHEMBL1310217 0.82 MC1R (0.57) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1479/4885APP 3016/4885

“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.