SCHEMBL8571024

SCHEMBL8571024

CN1CCCCC1N(N)C=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 4/20 0.32
ADH1C P00326 3/20 0.32
CYP1A2 P05177 1/20 0.32
ADH4 P08319 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
SCHEMBL2885312 0.70 CYP1A2 (0.38) CYP1A2
SCHEMBL14499455 0.69 CYP1A2 (0.43) CYP1A2
SCHEMBL14499454 0.69 CYP1A2 (0.43) CYP1A2
SCHEMBL14499453 0.69 CYP1A2 (0.43) CYP1A2
SCHEMBL27723452 0.69 HSD17B10 (0.40)
SCHEMBL21884120 0.68 CYP1A2 (0.31) CYP1A2
SCHEMBL21884133 0.67 CYP1A2 (0.30) CYP1A2
SCHEMBL6823815 0.67 CYP1A2 (0.32) CYP1A2
SCHEMBL21884149 0.66
Formamide SCHEMBL4415470 0.65 HPGD (0.35) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0931078-A1 NOVEL TRICYCLIC PIPERIDINYL COMPOUNDS USEFUL AS INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORPORATION (US) 1999-07-28 EP disclosed
WO-1998011098-A1 NOVEL TRICYCLIC PIPERIDINYL COMPOUNDS USEFUL AS INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORPORATION (US) 1998-03-19 WO disclosed