SCHEMBL8798529

SCHEMBL8798529

CCc1ccc2c(c1)C(C(=O)O)c1ccccc1CO2

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 3/20 0.41
AKR1B1 P15121 1/20 0.41
TBXA2R P21731 4/20 0.40
PARP1 P09874 1/20 0.40
HCRTR2 O43614 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL8797377 0.83 TBXA2R (0.44) TBXAS1TBXA2RMAPT
SCHEMBL7518917 0.82 PARP1 (0.41) TBXAS1TBXA2RPARP1HCRTR2POLB
SCHEMBL5756742 0.80 ATM (0.43) TBXAS1TBXA2R
SCHEMBL5756737 0.80 ATM (0.43) TBXAS1TBXA2R
SCHEMBL6938853 0.80 TBXA2R (0.45) TBXAS1TBXA2R
SCHEMBL8797894 0.80 TBXA2R (0.40) TBXAS1TBXA2R
SCHEMBL8797055 0.80 TP53 (0.38) POLBMAPTTDP1
SCHEMBL8797251 0.80 NOTUM (0.43) TBXAS1TBXA2R
SCHEMBL8797275 0.80 MAOB (0.44) TBXAS1TBXA2RPOLBMAPTTHRB
SCHEMBL8797046 0.80 TBXA2R (0.46) TBXAS1TBXA2R

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-0497201-B1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO KK (JP) 1997-01-15 EP disclosed
US-5478835-A Acyl coenzyme A: acyltransferase inhibitors; treatment of hyperlipemia and arteriosclerosis KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-12-26 US disclosed
US-5340807-A Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-08-23 US disclosed
EP-0497201-A1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-08-05 EP disclosed