SCHEMBL9507371

SCHEMBL9507371

CCCCOC(C)CCC(C)Oc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.58
PLA2G4B P0C869 7/20 0.52
TP53 P04637 1/20 0.51
TSHR P16473 1/20 0.51
KMT2A Q03164 1/20 0.50
PLA2G4A P47712 1/20 0.49
MAPK1 P28482 1/20 0.48

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
SCHEMBL9508656 1.00 RARB (0.58) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL9507377 1.00 RARB (0.58) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL9507826 0.96 RARB (0.65) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL9507818 0.96 RARB (0.65) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL9507432 0.95 RARB (0.52) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL9477903 0.89 RARB (0.61) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL8082310 0.88 RARB (0.63) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL8082284 0.88 RARB (0.63) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL8194653 0.88 RARB (0.63) RARBPLA2G4BTP53TSHRKMT2A
SCHEMBL8532922 0.88 RARB (0.63) RARBPLA2G4BTP53TSHRKMT2A

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-0388960-B1 OPTICALLY ACTIVE COMPOUNDS AND THEIR PREPARATION AND USE HITACHI, LTD. (JP) 1993-10-06 EP disclosed
US-5152919-A Stability, chemical resistance, high speed response, large spo ntaneous polarization, molecular orientation and wide temperat ure range HITACHI, LTD. (JP) 1992-10-06 US disclosed
EP-0388960-A1 Optically active compounds and their preparation and use HITACHI, LTD. (JP) 1990-09-26 EP disclosed