SCHEMBL9650419

SCHEMBL9650419

CCCCCCCCCC1CCC(CCc2cnc(-c3ccc(F)c(F)c3)nc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.43
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
MAPT P10636 3/20 0.40
HSD17B10 Q99714 3/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
PDE5A O76074 1/20 0.36
NPY5R Q15761 1/20 0.36
GCGR P47871 1/20 0.35
NPC1 O15118 3/20 0.34
RARA P10276 1/20 0.34
RARG P13631 1/20 0.34
TP53 P04637 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL9650178 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9648739 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9650173 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9650011 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9650414 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9650007 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9648727 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9646587 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9646591 1.00 RARB (0.43) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9649663 0.99 RARB (0.41) RARBRAB9ASMN1; SMN2MAPTHSD17B10

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-5167858-A Pyrimidine derivative and liquid crystal composition contain the same CHISSO CORPORATION (JP) 1992-12-01 US disclosed