SCHEMBL10692258

SCHEMBL10692258

Nc1c(N)c(F)c2ccccc2c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.42
ALDH1A1 P00352 7/20 0.42
HSD17B10 Q99714 6/20 0.42
HPGD P15428 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ACHE P22303 3/20 0.42
CASP1 P29466 3/20 0.42
CASP7 P55210 3/20 0.42
GLA P06280 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
CHRM2 P08172 1/20 0.42
ADRA2A P08913 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42
NQO2 P16083 1/20 0.42
MAOA P21397 1/20 0.42
DRD1 P21728 1/20 0.42
SLC6A2 P23975 1/20 0.42
ADRA1A P35348 1/20 0.42
OPRM1 P35372 1/20 0.42

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
SCHEMBL21525924 0.86 KDM4E (0.37) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL4949059 0.79 ALDH1A1 (0.41) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL30366320 0.76 ALDH1A1 (0.39) KDM4EALDH1A1HSD17B10SMN1; SMN2ACHE
SCHEMBL2887670 0.76 ALDH1A1 (0.39) KDM4EALDH1A1HSD17B10SMN1; SMN2ACHE
SCHEMBL6309502 0.76 HPRT1 (0.42) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL3674344 0.75 ACHE (0.35) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL22953480 0.75 HPRT1 (0.41) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL31610284 0.73 HPRT1 (0.41) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL3823621 0.73 HPRT1 (0.41) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL3673336 0.73 ALDH1A1 (0.43) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2

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-4792508-A STEREOISOMERIC NAPHTHALENE IMIDAZOLE PERYLENES, ARYL AMINES XEROX CORPORATION (US) 1988-12-20 US disclosed