SCHEMBL9763879

SCHEMBL9763879

CCCCCCCc1cnc(-c2ccc(-c3cc(F)c(F)c(F)c3)cc2)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.59
RAB9A P51151 6/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
MAPT P10636 4/20 0.56
HSD17B10 Q99714 3/20 0.56
MEN1 O00255 2/20 0.56
ALDH1A1 P00352 2/20 0.56
KMT2A Q03164 2/20 0.56
KDM4E B2RXH2 1/20 0.56
USP2 O75604 1/20 0.56
GAA P10253 1/20 0.56
HPGD P15428 1/20 0.56
RARA P10276 2/20 0.48
RARG P13631 1/20 0.48
NPC1 O15118 4/20 0.44
STAT3 P40763 1/20 0.44
ATM Q13315 1/20 0.44
MTOR P42345 1/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41

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
SCHEMBL9764040 1.00 RARB (0.59) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9764375 1.00 RARB (0.59) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763833 1.00 RARB (0.59) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763567 1.00 RARB (0.59) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL7918122 0.99 RARB (0.57) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9764348 0.94 RARB (0.51) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763848 0.91 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763641 0.91 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763490 0.91 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763897 0.91 RARB (0.54) 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-5032313-A Trifluorobenzene derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1991-07-16 US disclosed