SCHEMBL9327798

SCHEMBL9327798

CCCCCCCCCCC=COc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.62
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
PLA2G4B P0C869 5/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
RARA P10276 1/20 0.54
MAPT P10636 1/20 0.54
MTOR P42345 1/20 0.54
KMT2A Q03164 1/20 0.54
PTPN11 Q06124 1/20 0.49
PLA2G4A P47712 1/20 0.49

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
SCHEMBL8606866 1.00 RARB (0.62) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9328621 1.00 RARB (0.62) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9328627 1.00 RARB (0.62) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9327795 1.00 RARB (0.62) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL8378126 0.96 TP53 (0.59) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL8378127 0.96 TP53 (0.59) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL6925756 0.96 TP53 (0.59) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9330072 0.94 RARB (0.57) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9225196 0.90 TP53 (0.54) RARBTP53TSHRPLA2G4BALDH1A1
SCHEMBL9225206 0.90 TP53 (0.54) RARBTP53TSHRPLA2G4BALDH1A1

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
EP-0296571-B1 Method of producing a liquid crystal optical element IDEMITSU KOSAN CO (JP) 1994-03-30 EP disclosed