SCHEMBL9229100

SCHEMBL9229100

CCCCCCc1cnc(-c2ccc(OC(F)=C(F)F)cc2)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.59
RAB9A P51151 7/20 0.52
MAPT P10636 6/20 0.52
SMN1; SMN2 Q16637 5/20 0.52
KDM4E B2RXH2 2/20 0.52
HSD17B10 Q99714 2/20 0.52
MEN1 O00255 2/20 0.52
ALDH1A1 P00352 2/20 0.52
KMT2A Q03164 2/20 0.52
USP2 O75604 1/20 0.52
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
NPC1 O15118 5/20 0.45
STAT3 P40763 1/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL9227800 1.00 RARB (0.59) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9229844 0.99 RARB (0.56) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9227443 0.95 RARB (0.51) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9220694 0.89 MAPT (0.45) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9223992 0.84 TP53 (0.43) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9268500 0.82 RARB (0.65) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL14295767 0.82 RARB (0.65) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6948263 0.82 RARB (0.65) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9817449 0.82 RARB (0.70) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9817550 0.82 RARB (0.70) RARBRAB9AMAPTSMN1; SMN2KDM4E

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-5403512-A Fluorovinyloxybenzenes having low viscosity, stability, high; dielectric anisotropy and good low temperature behavior; displays; twisted cells MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-04-04 US disclosed