SCHEMBL8615128

SCHEMBL8615128

COc1ccc2c(c1)C(CNC(=O)Nc1c(C(C)C)cccc1C(C)C)c1ccccc1CO2

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 3/20 0.48
SOAT1 P35610 5/20 0.47
EDNRB P24530 1/20 0.41
EDNRA P25101 1/20 0.41

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
SCHEMBL8620559 0.88 LPAR1 (0.44) LPAR1SOAT1
SCHEMBL9330173 0.88 SOAT1 (0.46) SOAT1
SCHEMBL8613749 0.87 LPAR1 (0.45) LPAR1SOAT1
SCHEMBL8797398 0.84 LPAR1 (0.49) LPAR1SOAT1EDNRBEDNRA
SCHEMBL8618759 0.79 TBXA2R (0.40)
SCHEMBL8618649 0.77 SOAT1 (0.39) LPAR1SOAT1
SCHEMBL8618222 0.76 SOAT1 (0.40) LPAR1SOAT1
Hydrochloric Acid SCHEMBL8619453 0.75 SOAT1 (0.39) LPAR1SOAT1
SCHEMBL8614670 0.75 TBXA2R (0.47) EDNRBEDNRA
SCHEMBL9501263 0.75 SOAT1 (0.51) LPAR1SOAT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0588608-B1 Tricyclic compounds and pharmaceutical compositions containing them KYOWA HAKKO KOGYO KK (JP) 1998-05-06 EP disclosed
EP-0588608-A2 Tricyclic compounds and pharmaceutical compositions containing them KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-03-23 EP disclosed