SCHEMBL9507105

SCHEMBL9507105

CCCCCc1cnc(-c2cc(F)c(F)c(F)c2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.51
RAB9A P51151 6/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
MAPT P10636 3/20 0.48
HSD17B10 Q99714 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
RARA P10276 1/20 0.40
RARG P13631 1/20 0.40
NPC1 O15118 4/20 0.40
NFKB1 P19838 2/20 0.40
NFKB2 Q00653 2/20 0.40
RELA Q04206 2/20 0.40
STAT3 P40763 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL9763848 0.98 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763490 0.98 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763641 0.98 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763897 0.98 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763739 0.98 RARB (0.54) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763609 0.95 RARB (0.46) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL7918122 0.91 RARB (0.57) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9763567 0.90 RARB (0.59) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9764375 0.90 RARB (0.59) RARBRAB9ASMN1; SMN2MAPTHSD17B10
SCHEMBL9764040 0.90 RARB (0.59) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0387032-B1 TRIFLUOROBENZENE DERIVATIVES AND LIQUID CRYSTAL COMPOSITIONS CONTAINING THE SAME CHISSO CORP (JP) 1993-06-16 EP disclosed
US-5032313-A Trifluorobenzene derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1991-07-16 US disclosed
EP-0387032-A1 Trifluorobenzene derivatives and liquid crystal compositions containing the same Chisso Corporation (JP) 1990-09-12 EP disclosed