SCHEMBL9710392

SCHEMBL9710392

C#Cc1ccc(CCCCCCCCCC)c(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.44
TP53 P04637 2/20 0.44
CYP3A4 P08684 2/20 0.44
MEN1 O00255 1/20 0.44
ALOX5 P09917 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LIPG Q9Y5X9 1/20 0.38
THRA P10827 2/20 0.34
THRB P10828 2/20 0.34
ESR1 P03372 2/20 0.33
ADRA2A P08913 2/20 0.33
ADORA3 P0DMS8 2/20 0.33
TACR2 P21452 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 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
SCHEMBL9710309 1.00 TYR (0.44) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL9710325 1.00 TYR (0.44) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL27662460 0.86 CTSL (0.36)
SCHEMBL9723264 0.83 TYR (0.44) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL10520219 0.83 TYR (0.44) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL9723171 0.81 TYR (0.41) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL27662654 0.78
SCHEMBL7858565 0.76 HSD17B10 (0.49) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL7858727 0.76 HSD17B10 (0.49) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL7857705 0.76 HSD17B10 (0.49) TYRTP53CYP3A4MEN1ALOX5

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
EP-0518636-A1 Liquid crystal compounds and compositions SANYO CHEMICAL INDUSTRIES LTD. (JP) 1992-12-16 EP disclosed