SCHEMBL9202903

SCHEMBL9202903

COC(=O)c1cccc(C/C=C/c2cccc(CCc3ccc4ccc(Cl)cc4n3)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.45
▸ CYP4F2 P78329 3/20 0.42
▸ CYP4A11 Q02928 3/20 0.42
▸ CYSLTR1 Q9Y271 2/20 0.41
▸ MRGPRX4 Q96LA9 1/20 0.39
▸ LTB4R Q15722 2/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ TBXA2R P21731 1/20 0.39
▸ LOXL2 Q9Y4K0 1/20 0.38
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ CYSLTR2 Q9NS75 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL9202908 1.00 PLA2G2A (0.45) PLA2G2ACYP4F2CYP4A11CYSLTR1MRGPRX4
SCHEMBL9203804 0.86 PLA2G2A (0.50) PLA2G2ACYP4F2CYP4A11
SCHEMBL9203800 0.86 PLA2G2A (0.50) PLA2G2ACYP4F2CYP4A11
SCHEMBL9210323 0.78 LTB4R (0.49) PLA2G2ALTB4R
SCHEMBL9207699 0.78 PLA2G2A (0.47) PLA2G2ACYP4F2CYP4A11CYSLTR1LTB4R
SCHEMBL9207543 0.78 CYSLTR2 (0.40) PLA2G2ACYSLTR1CYSLTR2
SCHEMBL9207540 0.78 CYSLTR2 (0.40) PLA2G2ACYSLTR1CYSLTR2
SCHEMBL9747317 0.77 ALDH1A1 (0.37) PLA2G2ACYSLTR1CYSLTR2
SCHEMBL9209480 0.77 CYSLTR2 (0.37) CYSLTR1CYSLTR2
SCHEMBL9209485 0.77 CYSLTR2 (0.37) CYSLTR1CYSLTR2

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
EP-0399818-B1 Diarylstyrylquinoline diacids MERCK FROSST CANADA INC (CA) 1995-08-16 — — EP disclosed
US-5204358-A Antiallergens; antiinflammatory agents; treatment of asthma, rhinitis, bronchitis and skin diseases MERCK FROSST CANADA, INC. (CA) 1993-04-20 — — US disclosed
US-5104882-A Leukotriene antagonists MERCK FROSST CANADA, INC. (CA) 1992-04-14 — — US disclosed
EP-0399818-A1 Diarylstyrylquinoline diacids MERCK FROSST CANADA INC. (CA) 1990-11-28 — — EP disclosed
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