SCHEMBL9036244

SCHEMBL9036244

[CH2]CC1CCCC1C(=O)OC(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL1169927 0.81 TSHR (0.40) POLBNPSR1TSHR
SCHEMBL17706547 0.80 ALDH1A1 (0.33) POLBNPSR1
SCHEMBL1169668 0.77 TSHR (0.40) POLBNPSR1TSHR
SCHEMBL1245700 0.77 TSHR (0.40) POLBNPSR1TSHR
SCHEMBL1246352 0.77 TSHR (0.40) POLBNPSR1TSHR
SCHEMBL1245703 0.77 TSHR (0.40) POLBNPSR1TSHR
SCHEMBL1297387 0.76 TSHR (0.36) POLBNPSR1TSHR
SCHEMBL1170184 0.75 TSHR (0.39) POLBNPSR1TSHR
SCHEMBL14472355 0.74 EPHX1 (0.45) POLBNPSR1TSHR
SCHEMBL1244534 0.71 EPHX1 (0.40) POLBNPSR1TSHR

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-0450066-B1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMA CO LTD (JP) 1996-09-11 EP disclosed
US-5401740-A FOR INHIBITING PLATELET AGGREGATION OTSUKA PHARMACEUTICAL CO. (JP) 1995-03-28 US disclosed
US-5227381-A Anticoagulant OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-13 US disclosed
EP-0450066-A1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-10-09 EP disclosed