SCHEMBL1462408

SCHEMBL1462408

C1CCC(C2CCNCC2)NC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MBTD1 Q05BQ5 3/20 0.41
L3MBTL3 Q96JM7 2/20 0.41
EPAS1 Q99814 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
EPHX1 P07099 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
SCHEMBL16281659 1.00 MBTD1 (0.41) MBTD1L3MBTL3EPAS1L3MBTL1OPRM1
Hydrochloric Acid SCHEMBL4068811 0.95 MBTD1 (0.39) MBTD1L3MBTL3EPAS1L3MBTL1OPRM1
SCHEMBL13344223 0.92 MBTD1 (0.46) MBTD1L3MBTL3EPAS1L3MBTL1
Formic Acid SCHEMBL27743045 0.88 MBTD1 (0.41) MBTD1L3MBTL3L3MBTL1EPHX1
SCHEMBL26720816 0.87 EPAS1 (0.42) MBTD1L3MBTL3EPAS1L3MBTL1OPRM1
SCHEMBL11570313 0.87 EPAS1 (0.42) MBTD1L3MBTL3EPAS1L3MBTL1OPRM1
SCHEMBL8603609 0.87 EPAS1 (0.42) MBTD1L3MBTL3EPAS1L3MBTL1OPRM1
SCHEMBL4783327 0.87 EPAS1 (0.42) MBTD1L3MBTL3EPAS1L3MBTL1OPRM1
SCHEMBL11570310 0.87 EPAS1 (0.42) MBTD1L3MBTL3EPAS1L3MBTL1OPRM1
SCHEMBL3719347 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111386118-A Combination pharmaceutical agents as RSV inhibitors 英安塔制药有限公司 2020-07-07 CN claimed
CN-109851610-B Bicyclic aza compounds as muscarinic M1 and/or M4 receptor agonists 赫普泰雅治疗有限公司 2021-09-21 CN disclosed
EP-2475643-A1 NOVEL ETHANE DIAMINE HEPCIDIN ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2012-07-18 EP disclosed
WO-2011026959-A1 NOVEL ETHANE DIAMINE HEPCIDIN ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2011-03-10 WO disclosed
EP-1060785-B1 Interfacially polymerized, bipiperidine-polyamide membranes for reverse osmosis and/or nanofiltration and process for making the same HYDRANAUTICS (US) 2006-04-05 EP disclosed
US-6464873-B1 POLYFUNCTIONAL AROMATIC OR CYCLOALIPHATIC ACYL HALIDE REACTANT; HIGH FLUX RATES AND LOW PRESSURES WITH HIGH SULFATE REJECTION. HYDRANAUTICS 2002-10-15 US disclosed
US-6303614-B1 FOR THERAPY PSYCHOTIC DISORDER SELECTED FROM DEPRESSION, ANXIETY OR PSYCHOSIS JANSSEN PHARMACEUTICA N.V. (BE) 2001-10-16 US disclosed
EP-1060785-A1 Interfacially polymerized, bipiperidine-polyamide membranes for reverse osmosis and/or nanofiltration and process for making the same HYDRANAUTICS (US) 2000-12-20 EP disclosed
US-5215967-A AMINOACID DERIVATIVES INHIBITING RENIN MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-06-01 US disclosed