SCHEMBL7838644

SCHEMBL7838644

CCCCCCOCCOc1ccc(C(=O)O)cc1

nearest known ligand 0.85

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.85
TSHR P16473 1/20 0.85
RARB P10826 4/20 0.83
PLA2G4B P0C869 8/20 0.82
PLA2G4A P47712 1/20 0.74
HTT P42858 1/20 0.64
PLA2G2A P14555 1/20 0.60
PTPN11 Q06124 1/20 0.60
PKM P14618 1/20 0.58

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
SCHEMBL10358713 1.00 TP53 (0.85) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL10357796 1.00 TP53 (0.85) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL10782387 1.00 TP53 (0.85) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL7836467 1.00 TP53 (0.85) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL10785291 1.00 TP53 (0.85) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL10781475 1.00 TP53 (0.85) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL10780502 1.00 TP53 (0.85) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL10358386 0.96 RARB (0.92) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL31603897 0.95 RARB (0.91) TP53TSHRRARBPLA2G4BPLA2G4A
SCHEMBL7272084 0.95 RARB (0.91) TP53TSHRRARBPLA2G4BPLA2G4A

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-0751133-B1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI CHEMICALS INC (JP) 2001-09-12 EP disclosed
US-5770108-A HIGH SPEED RESPONSE, MOLECULAR ORIENTATION, HIGH CONTRAST, RECEPTIVITY MITSUI TOATSU CHEMICALS, INC. (JP) 1998-06-23 US disclosed
EP-0751133-A1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-02 EP disclosed