SCHEMBL6562349

SCHEMBL6562349

CCCc1ccc(-c2ccc(C(=O)Oc3ccc(C(=O)O[C@H](C)CC(CC)CC)c(F)c3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
THRB P10828 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
SENP8 Q96LD8 2/20 0.39
SENP7 Q9BQF6 2/20 0.39
SENP6 Q9GZR1 2/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
RAB9A P51151 1/20 0.39
RARB P10826 4/20 0.38
RARA P10276 2/20 0.38
RARG P13631 1/20 0.38
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
PLA2G1B P04054 1/20 0.34
KMT2A Q03164 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34
PRSS1 P07477 2/20 0.34
ACR P10323 1/20 0.34
MCL1 Q07820 1/20 0.34

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
SCHEMBL6547930 0.92 MAPT (0.37) MAPTTHRBRARBRARAKMT2A
SCHEMBL6547169 0.90 ALDH1A1 (0.40) MAPTKMT2APRSS1TMPRSS15
SCHEMBL6564025 0.87 MAPT (0.52) MAPTTHRBSMN1; SMN2SENP8SENP7
SCHEMBL6562379 0.87 MAPT (0.52) MAPTTHRBSMN1; SMN2SENP8SENP7
SCHEMBL6563804 0.84 KMT2A (0.37) MAPTRAB9AKMT2APRSS1TMPRSS15
SCHEMBL6562073 0.82 CYP4F2 (0.48) MAPTTHRBSMN1; SMN2RARBRARA
SCHEMBL6563854 0.81 MAPT (0.47) MAPTTHRBSMN1; SMN2NPC1RARB
SCHEMBL6560933 0.80 MAPT (0.52) MAPTTHRBSMN1; SMN2NPC1RARB
SCHEMBL6562354 0.79 RARB (0.41) MAPTSMN1; SMN2NPC1RAB9ARARB
SCHEMBL6561998 0.79 TP53 (0.46) MAPTTHRBSMN1; SMN2KMT2APRSS1

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-1225212-B1 Optically active compound and liquid crystal composition containing the compound MITSUBISHI GAS CHEMICAL CO (JP) 2004-03-24 EP disclosed
US-6677475-B2 FOR USE IN LIQUID CRYSTAL DISPLAY DEVICE MITSUBISHI GAS CHEMICAL CO., INC. (JP) 2004-01-13 US disclosed
EP-1225212-A1 Optically active compound and liquid crystal composition containing the compound MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2002-07-24 EP disclosed