SCHEMBL1948149

SCHEMBL1948149

COc1ccc([C@@H]2CN(c3cccnn3)C(C)[C@H]2C(=O)O)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MC4R P32245 6/20 0.42
MC3R P41968 4/20 0.42
DPP4 P27487 1/20 0.42
DPP8 Q6V1X1 1/20 0.42
DPP9 Q86TI2 1/20 0.42
MC1R Q01726 2/20 0.40
CPS1 P31327 6/20 0.39
GLS O94925 5/20 0.37
FPR1 P21462 2/20 0.36
FPR2 P25090 2/20 0.36

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
SCHEMBL15016246 0.81 MC4R (0.55) MC4RMC3RDPP4DPP8DPP9
SCHEMBL1921096 0.81 MC4R (0.55) MC4RMC3RDPP4DPP8DPP9
SCHEMBL15016245 0.81 MC4R (0.55) MC4RMC3RDPP4DPP8DPP9
SCHEMBL1945992 0.80 KDM4E (0.43) MC4RCPS1FPR1FPR2
SCHEMBL1948146 0.77 MC4R (0.52) MC4RMC3RDPP4DPP8DPP9
SCHEMBL1946750 0.73 SIGMAR1 (0.45) CPS1
SCHEMBL2307986 0.71 PANK3 (0.42) MC4RMC3R
SCHEMBL1946770 0.69 DPP4 (0.47) MC4RMC3RDPP4MC1R
SCHEMBL1920198 0.67 KMT2A (0.48) MC4RCPS1FPR1FPR2
SCHEMBL10288350 0.67 FFAR1 (0.47) CPS1FPR1FPR2

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-20110136814-A1 Diazepine and Diazocane Compounds As MC4 Agonists ANDREWS MARK DAVID 2011-06-09 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-20110136814-A1 Diazepine and Diazocane Compounds As MC4 Agonists MC4R, CHRM4, GPR4 MC4R 1/4885MC3R 16/4885DPP4 261/4885

“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.