SCHEMBL6002545

SCHEMBL6002545

CC(C)(C)OC(=O)N1CC2(CCNCC2)c2ncc(Cl)cc21

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.35
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
PIK3CA P42336 1/20 0.32
KDM1A O60341 1/20 0.32
CCNC P24863 1/20 0.32
CDK8 P49336 1/20 0.32
NOTUM Q6P988 1/20 0.32
OXTR P30559 1/20 0.32
AVPR1A P37288 1/20 0.32

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
SCHEMBL29713511 0.82 NR1H2 (0.39) NR1H2CTSLCTSSKDM1AOXTR
SCHEMBL15649736 0.82 NR1H2 (0.39) NR1H2CTSLCTSSKDM1AOXTR
SCHEMBL20955744 0.78 NOTUM (0.57) KDM1ANOTUMOXTRAVPR1A
SCHEMBL1997435 0.74 PROKR1 (0.40)
SCHEMBL2123391 0.74 PIK3CA (0.41) NR1H2CTSLCTSSPIK3CA
SCHEMBL6002974 0.73 CYP11B2 (0.38) NR1H2KDM1ANOTUM
SCHEMBL5599315 0.73 DPP4 (0.37) KDM1ANOTUM
SCHEMBL1195029 0.73 AKT1 (0.41) KDM1ANOTUM
Hydrochloric Acid SCHEMBL17008459 0.72 AKT1 (0.41) KDM1ANOTUM
SCHEMBL1222469 0.72 NOTUM (0.53) KDM1ANOTUM

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-1694677-A1 SPIROPIPERIDINE DERIVATIVES FOR CONTROLLING PESTS Syngenta Participations AG (CH) 2006-08-30 EP disclosed
WO-2005061500-A1 SPIROPIPERIDINE DERIVATIVES FOR CONTROLLING PESTS SYNGENTA PARTICIPATIONS AG (CH) 2005-07-07 WO disclosed