SCHEMBL8376359

SCHEMBL8376359

C=C1CC(CCC)(C(=O)O)C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 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
SCHEMBL1744236 0.83 CYP2C19 (0.31)
SCHEMBL14127769 0.81 CETP (0.33) CPB2
SCHEMBL3153596 0.75
SCHEMBL6386232 0.75 CETP (0.33) CPB2
SCHEMBL17696860 0.75 MME (0.44)
SCHEMBL4706256 0.74 CYP2C19 (0.31)
SCHEMBL2923075 0.74 CYP2C19 (0.56)
Hydrochloric Acid SCHEMBL11613521 0.73 CYP2C19 (0.38) CPB2
SCHEMBL4277564 0.71 CYP2C19 (0.52)
SCHEMBL4580987 0.71 CYP2C19 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3068785-A1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS Bristol-Myers Squibb Company (US) 2016-09-21 EP disclosed
EP-2958921-A1 PYRROLO [2, 3 -D]PYRIMIDINE DERIVATIVES AS INHIBITORS OF JANUS- RELATED KINASES (JAK) Pfizer Inc. (US) 2015-12-30 EP disclosed
WO-2015073763-A1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-05-21 WO disclosed
WO-2014128591-A1 PYRROLO [2, 3 -D]PYRIMIDINE DERIVATIVES AS INHIBITORS OF JANUS- RELATED KINASES (JAK) PFIZER INC. (US) 2014-08-28 WO disclosed
WO-1999031048-A1 FUNGICIDAL AMIDES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ARKANSAS (US) 1999-06-24 WO disclosed