SCHEMBL9699112

SCHEMBL9699112

CCCCCCCCCCCCOc1cc(C)cc(O)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.58
CNR1 P21554 14/20 0.52
CNR2 P34972 12/20 0.52
PLA2G2A P14555 1/20 0.51
LTA4H P09960 1/20 0.50
TP53 P04637 1/20 0.49
ALOX15 P16050 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
SCHEMBL17463438 0.93 LTA4H (0.52) NR5A1CNR1CNR2LTA4HTP53
SCHEMBL27574766 0.89 NR5A1 (0.66) NR5A1CNR1CNR2PLA2G2ALTA4H
SCHEMBL4417414 0.89 NR5A1 (0.66) NR5A1CNR1CNR2PLA2G2ALTA4H
SCHEMBL8889344 0.89 NR5A1 (0.66) NR5A1CNR1CNR2PLA2G2ALTA4H
SCHEMBL11802130 0.89 NR5A1 (0.66) NR5A1CNR1CNR2PLA2G2ALTA4H
SCHEMBL11806779 0.89 NR5A1 (0.66) NR5A1CNR1CNR2PLA2G2ALTA4H
SCHEMBL6816991 0.89 NR5A1 (0.66) NR5A1CNR1CNR2PLA2G2ALTA4H
SCHEMBL17204428 0.87 ELANE (0.54) NR5A1CNR1CNR2LTA4HTP53
SCHEMBL12550198 0.87 PLA2G2A (0.59) NR5A1CNR1CNR2PLA2G2ALTA4H
SCHEMBL1070543 0.87 TP53 (0.56) NR5A1PLA2G2ALTA4HTP53ALOX15

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-5147864-A Bronchodilator agent, antianaphylactic agent, antishock agent, cardiotonic agent and anticarcinogenic agent AMERICAN CYANAMID COMPANY (US) 1992-09-15 US disclosed
US-4983592-A Bis-arylphosphate ester antagonists of platelet activating factor AMERICAN CYANAMID CO. (US) 1991-01-08 US disclosed
EP-0374513-A2 Novel bis-arylphosphate ester antagonists of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1990-06-27 EP disclosed