SCHEMBL9841385

SCHEMBL9841385

CCCCCc1ccc(C(=O)Oc2ccc(S(F)(F)(F)(F)F)c(Cl)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
THRB P10828 7/20 0.44
THRA P10827 6/20 0.43
PRSS1 P07477 1/20 0.43
ACR P10323 1/20 0.43
NPC1 O15118 1/20 0.42
CASP3 P42574 1/20 0.42
RAB9A P51151 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
RARB P10826 5/20 0.41
PLA2G4A P47712 1/20 0.41
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RARA P10276 1/20 0.40
MTOR P42345 1/20 0.40
KMT2A Q03164 1/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL9841696 0.99 MAPT (0.45) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL9841186 0.99 MAPT (0.45) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL9841391 0.99 MAPT (0.45) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL9841344 0.97 MAPT (0.43) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL9841888 0.92 MAPT (0.50) MAPTSMN1; SMN2THRBPRSS1ACR
SCHEMBL9842076 0.88 RXRA (0.40) MAPTSMN1; SMN2PRSS1NPC1CASP3
SCHEMBL9841541 0.87 MAPT (0.47) MAPTSMN1; SMN2THRBTHRAPRSS1
SCHEMBL9842417 0.87 LMNA (0.54) MAPTSMN1; SMN2PRSS1ACRNPC1
SCHEMBL9841279 0.87 MAPT (0.52) MAPTSMN1; SMN2PRSS1ACRNPC1
SCHEMBL9841219 0.86 NPC1 (0.55) MAPTSMN1; SMN2PRSS1ACRNPC1

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-5055223-A For use in liquid crystal display elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-10-08 US disclosed