SCHEMBL9688516

SCHEMBL9688516

CCCCCCCCOc1ccc(-c2ccccc2C(=O)O)c(C(CC)OCCCCCCC)c1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 6/20 0.71
PLK1 P53350 1/20 0.49
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
PLA2G4B P0C869 3/20 0.46
PDK2 Q15119 2/20 0.45
RARB P10826 3/20 0.44

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
SCHEMBL10865251 1.00 PTPN11 (0.71) PTPN11PLK1TP53TSHRPLA2G4B
SCHEMBL27245982 0.84 PTPN11 (1.00) PTPN11PLK1TP53TSHRPLA2G4B
SCHEMBL10340830 0.84 PTPN11 (0.73) PTPN11PLK1TP53TSHRPLA2G4B
SCHEMBL9688552 0.83 PTPN11 (0.68) PTPN11TP53TSHRPLA2G4BRARB
SCHEMBL9688540 0.79 RARB (0.63) PTPN11TP53TSHRPLA2G4BRARB
SCHEMBL9689028 0.79 RARB (0.63) PTPN11TP53TSHRPLA2G4BRARB
SCHEMBL22832629 0.78 KDM4E (0.48) PTPN11PLK1TP53TSHRPLA2G4B
SCHEMBL9688537 0.76 PTPN11 (0.74) PTPN11PLK1TP53TSHRPLA2G4B
SCHEMBL17835424 0.75 PTPN11 (0.74) PTPN11PLK1TP53TSHRPLA2G4B
SCHEMBL10397754 0.75 PTPN11 (0.74) PTPN11PLK1TP53TSHRPLA2G4B

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-5167857-A Optically active, optical modulation CANON KABUSHIKI KAISHA (JP) 1992-12-01 US disclosed
EP-0175591-B1 LACTIC ACID DERIVATIVE, LIQUID CRYSTAL COMPOSITION CONTAINING SAME AND LIQUID CRYSTAL DEVICE CANON KABUSHIKI KAISHA (JP) 1991-03-06 EP disclosed
US-4775223-A DISPLAY DEVICE CANON KABUSHIKI KAISHA (JP) 1988-10-04 US disclosed
EP-0175591-A2 Lactic acid derivative, liquid crystal composition containing same and liquid crystal device CANON KABUSHIKI KAISHA (JP) 1986-03-26 EP disclosed