SCHEMBL7367053

SCHEMBL7367053

COC(=O)CC12CCCN(CC1)C2

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
USP2 O75604 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.30
CYP3A4 P08684 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 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
SCHEMBL7367363 0.93 TP53 (0.35) CHRM2CHRM4CHRM1CHRM3USP2
Bromide SCHEMBL10316864 0.81 CTSK (0.31)
SCHEMBL9053628 0.79 CYP2C19 (0.35) USP2SMN1; SMN2TSHRALDH1A1CYP1A2
SCHEMBL9696852 0.76 KMT2A (0.44) RAB9ASMN1; SMN2TSHRALDH1A1
SCHEMBL10316921 0.73 ALDH1A1 (0.44) ALDH1A1
Bromide SCHEMBL12004496 0.72 ALDH1A1 (0.43) ALDH1A1
SCHEMBL7434996 0.71
SCHEMBL22784325 0.70 GRM1 (0.38) USP2SMN1; SMN2TSHRALDH1A1CYP1A2
SCHEMBL2418813 0.70 CHRM2 (0.31) CHRM2CHRM4CHRM1CHRM3
SCHEMBL9696948 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5464842-A Azabicyclo oxime and amine cholinergic agents and methods of treatment WARNER-LAMBERT COMPANY (US) 1995-11-07 US disclosed
EP-0625981-A1 AZABICYCLO COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-11-30 EP disclosed
US-5318978-A Azabicyclo oxime and amine cholinergic agents and methods of treatment WARNER-LAMBERT COMPANY (US) 1994-06-07 US disclosed
WO-1993015080-A1 AZABICYCLO COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1993-08-05 WO disclosed
WO-1993008191-A1 AZABICYCLO OXIME AND AMINE CHOLINERGIC AGENTS AND METHODS OF TREATMENT WARNER-LAMBERT COMPANY (US) 1993-04-29 WO disclosed
US-5091397-A Cognition activators BEECHAM GROUP P.L.C. (GB) 1992-02-25 US disclosed
EP-0363085-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-04-11 EP disclosed