SCHEMBL9294286

SCHEMBL9294286

CC(N)C1CCC(C(=O)O)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 3/20 0.41
ROCK1 Q13464 3/20 0.41
PKN2 Q16513 3/20 0.41
RPS6KA5 O75582 2/20 0.41
LRRK2 Q5S007 2/20 0.41
TP53 P04637 2/20 0.41
CYP3A4 P08684 2/20 0.41
CHUK O15111 1/20 0.41
PRKD3 O94806 1/20 0.41
CDK1 P06493 1/20 0.41
CDK2 P24941 1/20 0.41
LTK P29376 1/20 0.41
CDK8 P49336 1/20 0.41
PRKX P51817 1/20 0.41
CDK5 Q00535 1/20 0.41
PRKCQ Q04759 1/20 0.41
PRKCD Q05655 1/20 0.41
STK3 Q13188 1/20 0.41
PRKG2 Q13237 1/20 0.41
CDC42BPA Q5VT25 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
SCHEMBL9504406 0.88 ANPEP (0.46) TSHRLMNASLC1A2SLC1A1GABRR1
SCHEMBL9505565 0.88 ANPEP (0.46) TSHRLMNASLC1A2SLC1A1GABRR1
SCHEMBL9504417 0.88 ANPEP (0.46) TSHRLMNASLC1A2SLC1A1GABRR1
SCHEMBL9505616 0.87 ROCK2 (0.46) ROCK2ROCK1PKN2RPS6KA5LRRK2
SCHEMBL5147855 0.87 ROCK2 (0.46) ROCK2ROCK1PKN2RPS6KA5LRRK2
SCHEMBL3501685 0.87 ROCK2 (0.46) ROCK2ROCK1PKN2RPS6KA5LRRK2
SCHEMBL824158 0.83 ACE (0.39) ROCK2ROCK1TSHRLMNASLC1A2
SCHEMBL14436548 0.83 ACE (0.39) ROCK2ROCK1TSHRLMNASLC1A2
SCHEMBL25544633 0.83 ACE (0.39) ROCK2ROCK1TSHRLMNASLC1A2
SCHEMBL25544782 0.83 ACE (0.39) ROCK2ROCK1TSHRLMNASLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109053742-A New tricyclic compound ABBVIE 公司 2018-12-21 CN disclosed
CN-108774237-A New tricyclic compound ABBVIE 公司 2018-11-09 CN disclosed
CN-104370909-B Tricyclic compound ABBVIE 公司 2018-09-11 CN disclosed
CN-104370909-A Novel tricyclic compounds ABBOTT LAB 2015-02-25 CN disclosed
US-RE34722-E Antiulcer agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-06 US disclosed
EP-0329105-B1 MOLECULAR WEIGHT CONTROLLER FOR POLYMERIZATION OF LACTAMS TO POLYAMIDES BASF Corporation (US) 1993-07-07 EP disclosed
US-5006635-A Monofunctional amine, monofunctional acid, salt of aminoacid, polyamides BASF CORPORATION (US) 1991-04-09 US disclosed
EP-0329105-A2 Molecular weight controller for polymerization of lactams to polyamides BASF Corporation (US) 1989-08-23 EP disclosed
US-4844834-A Molecular weight controller for polymerization of lactams to polyamides BASF CORPORATION (US) 1989-07-04 US disclosed
US-4578381-A ANTIULCER AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-03-25 US disclosed