SCHEMBL9329016

SCHEMBL9329016

CCCCCC(F)COC(C)c1ccc(C(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
PLA2G4B P0C869 6/20 0.43
RARB P10826 8/20 0.41
MAPT P10636 2/20 0.40
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
PLA2G4A P47712 1/20 0.39

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
SCHEMBL9329632 0.80 TP53 (0.62) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL8162563 0.80 TP53 (0.62) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL9329676 0.80 TP53 (0.62) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL9547780 0.80 NR5A1 (0.36) TP53MAPTALDH1A1
SCHEMBL9547777 0.80 NR5A1 (0.36) TP53MAPTALDH1A1
SCHEMBL9547784 0.80 NR5A1 (0.36) TP53MAPTALDH1A1
SCHEMBL9257016 0.80 TP53 (0.57) TP53TSHRPLA2G4BRARBKMT2A
SCHEMBL9574389 0.80 PLA2G4B (0.63) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL9417076 0.78 PLA2G4B (0.65) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL9574428 0.78 PLA2G4B (0.65) TP53TSHRPLA2G4BRARBPLA2G4A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5332675-A Liquid crystals SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-07-26 US disclosed
EP-0289307-B1 OPTICALLY ACTIVE AROMATIC CARBOXYLIC ACID DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-07-08 EP disclosed
US-5019298-A Optically active aromatic carboxylic acid derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-28 US disclosed
EP-0289307-A2 Optically active aromatic carboxylic acid derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-02 EP disclosed