SCHEMBL7149700

SCHEMBL7149700

CC(C)(C)OC(=O)N1CC=C(CC(=O)O)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDK4 Q16654 1/20 0.49
GRM5 P41594 9/20 0.46
GRM1 Q13255 9/20 0.46
NAMPT P43490 1/20 0.43
HTR6 P50406 1/20 0.43
ESR2 Q92731 1/20 0.42
ADORA1 P30542 1/20 0.41
NR1H2 P55055 1/20 0.41
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GPR119 Q8TDV5 2/20 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
SCHEMBL2002272 0.85 PDK4 (0.48) PDK4GRM5GRM1NAMPTHTR6
SCHEMBL12566963 0.85 PDK4 (0.48) PDK4GRM5GRM1NAMPTHTR6
SCHEMBL29120639 0.85 PDK4 (0.40) PDK4GRM5GRM1NAMPTESR2
SCHEMBL2349369 0.84 PDK4 (0.47) PDK4GRM5GRM1NAMPTHTR6
SCHEMBL12074148 0.84 PDK4 (0.47) PDK4GRM5GRM1NAMPTHTR6
SCHEMBL28161050 0.84 PDK4 (0.47) PDK4GRM5GRM1NAMPTHTR6
SCHEMBL2003552 0.84 PDK4 (0.47) PDK4GRM5GRM1NAMPTHTR6
SCHEMBL6662189 0.84 PDK4 (0.47) PDK4GRM5GRM1NAMPTHTR6
SCHEMBL5392226 0.84 PDK4 (0.46) PDK4GRM5GRM1NAMPTHTR6
SCHEMBL4532704 0.83 PDK4 (0.46) PDK4GRM5GRM1NAMPTHTR6

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
US-7271174-B2 Metabolites of tricyclic amides useful for inhibition of G-protein function and methods of treatment of proliferative diseases SCHERING CORPORATION (US) 2007-09-18 US disclosed
US-7271174-B2 Metabolites of tricyclic amides useful for inhibition of G-protein function and methods of treatment of proliferative diseases SCHERING CORPORATION (US) 2007-09-18 US disclosed
US-6518423-B1 These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and EISAI CO., LTD. (JP) 2003-02-11 US disclosed
EP-0934941-A1 BENZOPIPERIDINE DERIVATIVES Eisai Co., Ltd. (JP) 1999-08-11 EP disclosed