SCHEMBL8307801

SCHEMBL8307801

Fc1ccc(CCC2CCNCC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.53
SLC6A4 P31645 4/20 0.44
SLC6A2 P23975 3/20 0.44
SLC6A3 Q01959 3/20 0.44
HTR1A P08908 2/20 0.44
HRH3 Q9Y5N1 1/20 0.44
GBA1 P04062 1/20 0.43
TACR1 P25103 1/20 0.43
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43

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
SCHEMBL20015572 0.93 MAOB (0.48) MAOBSLC6A4SLC6A2SLC6A3HTR1A
SCHEMBL9093168 0.89 HRH3 (0.49) MAOBHRH3
SCHEMBL4319526 0.89 TACR1 (0.50) MAOBSLC6A4SLC6A2SLC6A3HTR1A
Hydrochloric Acid SCHEMBL5764206 0.88 TACR1 (0.49) MAOBSLC6A4SLC6A2SLC6A3HTR1A
Trifluoroacetic Acid SCHEMBL19994597 0.88 ITGB3 (0.50) MAOBSLC6A4SLC6A2SLC6A3TACR1
SCHEMBL3716138 0.86 MAOB (0.60) MAOB
SCHEMBL18715291 0.82 MAOB (0.57) MAOB
SCHEMBL9562394 0.82 MAOB (0.55) MAOBSLC6A4SLC6A2HRH3TACR1
SCHEMBL1199744 0.81 MAOB (0.53) MAOBSLC6A4SLC6A2SLC6A3HRH3
SCHEMBL4244293 0.81 MAOB (0.53) MAOBSLC6A4SLC6A2HRH3GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018055096-A1 DISUBTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES AS INHIBITORS OF MONOAMINE OXIDASE B FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES UNIVERSITY OF LJUBLJANA (SI) 2018-03-29 WO disclosed
EP-3290416-A1 SUBSTITUTED N-[2-(4-PHENOXYPIPERIDIN-1-YL)-2-(1,3-THIAZOL-5-YL)ETHYL]BENZAMIDE AND N-[2-(4-BENZYLOXYPIPERIDIN-1-YL)-2-(1,3-THIAZOL-5-YL)ETHYL]BENZAMIDE DERIVATIVES AND THEIR USE AS P2X7 RECEPTOR ANTAGONIST AXXAM S.p.A. (IT) 2018-03-07 EP disclosed
CN-102459248-A Benzoxepin as PI3K/mTOR inhibitors and methods of their use and manufacture EXELIXIS INC 2012-05-16 CN disclosed
CN-1989127-A Kynurenic acid amide derivatives as NR2B receptor antagonists RICHTER GEDEON VEGYESZET (HU) 2007-06-27 CN disclosed
EP-0929550-A1 $i(N)-(BENZOTHIAZOL-2-YL) PIPERIDINE-1-ETHANAMINE DERIVATIVES, THEIR PREPARATION AND APPLICATION IN THERAPEUTICS SYNTHELABO (FR) 1999-07-21 EP disclosed
WO-1998014444-A1 N-(BENZOTHIAZOL-2-YL) PIPERIDINE-1-ETHANAMINE DERIVATIVES, THEIR PREPARATION AND APPLICATION IN THERAPEUTICS SYNTHELABO (FR) 1998-04-09 WO disclosed
EP-0604494-A1 5-HT 4? RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-07-06 EP disclosed
CN-1069491-A 2-(piperidines-1-yl) alcohol derivative, its method for making and treatment thereof are used SYNTHELABO (FR) 1993-03-03 CN disclosed
EP-0524846-A1 2-(Piperidin-1-yl)ethanol derivatives, their preparation and their use in therapeutics SYNTHELABO (FR) 1993-01-27 EP disclosed
US-4077958-A ANTIDEPRESSANTS E. R. SQUIBB & SONS, INC. (US) 1978-03-07 US disclosed
US-4007191-A ANTIDEPRESSANT E. R. SQUIBB & SONS, INC. (US) 1977-02-08 US disclosed
US-3935227-A ANTIDEPRESSANTS, ANTIANXIETY, ANTIINFLAMMATORY AGENTS E. R. SQUIBB & SONS, INC. (US) 1976-01-27 US disclosed