SCHEMBL11246307

SCHEMBL11246307

CCN(CC)c1ccc(C2(N(c3ccccc3)c3ccccc3)OC(=O)c3cnccc32)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.38
GFER P55789 2/20 0.38
CYP2C19 P33261 1/20 0.38
RPS6KA2 Q15349 1/20 0.38
MAPT P10636 10/20 0.33
ALDH1A1 P00352 6/20 0.33
HSD17B10 Q99714 5/20 0.33
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
KDM4E B2RXH2 4/20 0.33
HTT P42858 4/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
NPC1 O15118 3/20 0.33
LMNA P02545 2/20 0.33
RAB9A P51151 2/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
CASP1 P29466 3/20 0.33
CASP7 P55210 3/20 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
SCHEMBL11239287 0.92 NPSR1 (0.38) NPSR1GFERCYP2C19RPS6KA2MAPT
SCHEMBL11380886 0.87 RPS6KA2 (0.44) NPSR1CYP2C19RPS6KA2MAPTALDH1A1
SCHEMBL11245434 0.87 TRPV1 (0.35) NPSR1GFERCYP2C19L3MBTL1IGLV6-57
SCHEMBL11230933 0.85 MEN1 (0.35) NPSR1GFERMAPTALDH1A1HSD17B10
SCHEMBL11243023 0.85 GFER (0.37) NPSR1GFERCYP2C19RPS6KA2MAPT
SCHEMBL11239064 0.84 ALDH1A1 (0.43) NPSR1MAPTALDH1A1HSD17B10MEN1
SCHEMBL11379160 0.84 MAPT (0.44) NPSR1GFERCYP2C19RPS6KA2MAPT
SCHEMBL11441219 0.83 RPS6KA2 (0.41) NPSR1CYP2C19RPS6KA2MAPTALDH1A1
SCHEMBL11364764 0.82 NPSR1 (0.40) NPSR1CYP2C19RPS6KA2MAPTALDH1A1
SCHEMBL11379713 0.81 ALDH1A1 (0.40) NPSR1CYP2C19RPS6KA2MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4337340-A FROM DIPHENYLAMINES AND BENZOYL OR 3-INDOLYLCARBONYL PYRIDINE- OR PYRAZINECARBOXYLIC ACIDS STERLING DRUG INC. (US) 1982-06-29 US disclosed
US-4243250-A FUROPYRIDINONES OR FUROPYRAZINONES AS COLOR FORMERS STERLING DRUG INC. (US) 1981-01-06 US disclosed
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 US disclosed