SCHEMBL9841588

SCHEMBL9841588

CCCc1ccc(C(=O)Oc2ccc(S(F)(F)(F)(F)F)c(F)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
THRB P10828 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
SENP8 Q96LD8 2/20 0.43
SENP7 Q9BQF6 2/20 0.43
SENP6 Q9GZR1 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
CASP3 P42574 1/20 0.43
KMT2A Q03164 2/20 0.42
PLA2G1B P04054 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
PRSS1 P07477 3/20 0.41
ACR P10323 2/20 0.41
ALOX5 P09917 1/20 0.40
PLK1 P53350 1/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 2/20 0.37
F2 P00734 1/20 0.37
PRSS2 P07478 1/20 0.37

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
SCHEMBL9841677 0.93 MAPT (0.43) MAPTTHRBSMN1; SMN2NPC1KMT2A
SCHEMBL9841541 0.92 MAPT (0.47) MAPTTHRBSMN1; SMN2KMT2APRSS1
SCHEMBL9841817 0.91 RXRA (0.40) MAPTTHRBNPC1RAB9AKMT2A
SCHEMBL9841905 0.91 PRSS1 (0.47) MAPTTHRBSMN1; SMN2KMT2APRSS1
SCHEMBL9841910 0.91 PRSS1 (0.47) MAPTTHRBSMN1; SMN2KMT2APRSS1
SCHEMBL9841931 0.91 PRSS1 (0.47) MAPTTHRBSMN1; SMN2KMT2APRSS1
SCHEMBL9841888 0.86 MAPT (0.50) MAPTTHRBSMN1; SMN2SENP8SENP7
SCHEMBL9841274 0.85 MAPT (0.53) MAPTSMN1; SMN2NPC1KMT2APRSS1
SCHEMBL9841437 0.85 KMT2A (0.50) MAPTTHRBNPC1KMT2APLK1
SCHEMBL15693579 0.83 MAPT (0.48) MAPTTHRBSMN1; SMN2SENP8SENP7

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