SCHEMBL144387

SCHEMBL144387

Cc1ccc(Cn2nc(C)cc2C(=O)Nc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.76
MAPT P10636 2/20 0.76
KMT2A Q03164 2/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
MAPK1 P28482 2/20 0.58
P2RY14 Q15391 1/20 0.56
PTGDR2 Q9Y5Y4 10/20 0.54
FLT1 P17948 2/20 0.53
KDR P35968 2/20 0.53
HTR1E P28566 1/20 0.52
S1PR3 Q99500 1/20 0.52
MEN1 O00255 1/20 0.51
NR3C1 P04150 1/20 0.51

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
SCHEMBL146791 0.92 NPSR1 (0.78) NPSR1MAPTKMT2ANPC1RAB9A
SCHEMBL1900773 0.91 NPSR1 (0.90) NPSR1MAPTKMT2ANPC1RAB9A
SCHEMBL147011 0.88 NPSR1 (0.65) NPSR1MAPTKMT2ANPC1RAB9A
SCHEMBL7744394 0.87 NPSR1 (0.64) NPSR1MAPTKMT2ANPC1RAB9A
SCHEMBL7744959 0.86 NPSR1 (1.00) NPSR1MAPTKMT2ANPC1RAB9A
SCHEMBL147214 0.81 MAPT (0.67) NPSR1MAPTKMT2ANPC1RAB9A
SCHEMBL147989 0.81 NPSR1 (0.80) NPSR1MAPTMAPK1PTGDR2HTR1E
SCHEMBL1897475 0.75 NPSR1 (0.48) NPSR1MAPTMAPK1P2RY14PTGDR2
SCHEMBL1897882 0.75 RAB9A (1.00) NPSR1MAPTKMT2ANPC1RAB9A
SCHEMBL1899459 0.75 NPSR1 (1.00) NPSR1MAPTKMT2ANPC1RAB9A

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-20120059047-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR VERVA PHARMACEUTICALS PTY LTD (AU) 2012-03-08 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-20120059047-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR FGF1, FABP4, FGF2 NPSR1 3871/4885MAPT 4367/4885KMT2A 3024/4885

“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.