SCHEMBL9689028

SCHEMBL9689028

CCCCCCCCOc1ccc(-c2ccc(C(=O)O)cc2C(CC)OCCCCCCC)cc1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.63
PTPN11 Q06124 3/20 0.63
TP53 P04637 1/20 0.60
TSHR P16473 1/20 0.60
PLA2G4B P0C869 8/20 0.59
PLA2G4A P47712 1/20 0.54
PLA2G2A P14555 1/20 0.50

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
SCHEMBL9688540 1.00 RARB (0.63) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL9688552 0.94 PTPN11 (0.68) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL9689012 0.88 RARB (0.64) RARBPTPN11
SCHEMBL9182244 0.83 RARB (0.76) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL5355718 0.83 RARB (0.76) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL9688532 0.82 RARB (0.54) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL10865254 0.82 RARB (0.54) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL5355722 0.81 PTPN11 (0.79) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL8376751 0.81 PTPN11 (0.79) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL7169579 0.81 RARB (0.72) RARBPTPN11TP53TSHRPLA2G4B

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
US-5167857-A Optically active, optical modulation CANON KABUSHIKI KAISHA (JP) 1992-12-01 US claimed
EP-0175591-B1 LACTIC ACID DERIVATIVE, LIQUID CRYSTAL COMPOSITION CONTAINING SAME AND LIQUID CRYSTAL DEVICE CANON KABUSHIKI KAISHA (JP) 1991-03-06 EP claimed
EP-0175591-A2 Lactic acid derivative, liquid crystal composition containing same and liquid crystal device CANON KABUSHIKI KAISHA (JP) 1986-03-26 EP claimed