SCHEMBL4846995

SCHEMBL4846995

CNCc1ccc2c(CN)cccc2c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MC5R P33032 3/20 0.45
MAPK1 P28482 1/20 0.45
NOS1 P29475 5/20 0.43
NOS3 P29474 3/20 0.43
IFNAR1 P17181 1/20 0.39
MC4R P32245 2/20 0.38
NOS2 P35228 1/20 0.38
ROCK1 Q13464 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
PRMT6 Q96LA8 1/20 0.37
ASH1L Q9NR48 1/20 0.37
MC3R P41968 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 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
SCHEMBL4846725 0.84 MC5R (0.50) MC5RMAPK1MC4RROCK1MC3R
SCHEMBL4847363 0.83 ROCK1 (0.49) MC5RMAPK1ROCK1
SCHEMBL15345818 0.81 CYP1A2 (0.50) MC5RMAPK1ROCK1
SCHEMBL4850098 0.79 MAPK1 (0.48) MC5RMAPK1NOS1NOS3IFNAR1
SCHEMBL15345803 0.79 LOXL2 (0.42) MC5RMAPK1
SCHEMBL4846769 0.77 CYP2D6 (0.42) MC5RMAPK1NOS1MC4RSLC6A2
SCHEMBL15345477 0.76 S1PR1 (0.47)
SCHEMBL4840652 0.75 MAPK1 (0.43) MC5RMAPK1NOS1IFNAR1NOS2
SCHEMBL4844999 0.75 HRH3 (0.41) MC5RMC4RMC3R
SCHEMBL15345427 0.75 CSNK2A2 (0.47) MC5RMAPK1ROCK1

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-7368462-B1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY (US) 2008-05-06 US disclosed
US-20080058423-A1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY 2008-03-06 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-20080058423-A1 Melanin concentrating hormone antagonists MCHR1, MCHR2, MC4R MC5R 5/4885MAPK1 2262/4885NOS1 2945/4885

“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.