SCHEMBL48800

SCHEMBL48800

OC1CN(C(c2ccccc2)c2ccccc2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 7/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
CHRM2 P08172 1/20 0.48
CHRM4 P08173 1/20 0.48
CHRM5 P08912 1/20 0.48
ADRA2A P08913 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CYP2D6 P10635 1/20 0.48
CHRM1 P11229 1/20 0.48
CHRM3 P20309 1/20 0.48
DRD1 P21728 1/20 0.48
ADRA1D P25100 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HRH1 P35367 1/20 0.48
DRD3 P35462 1/20 0.48
HTR2B P41595 1/20 0.48
SLC6A3 Q01959 1/20 0.48
KCNH2 Q12809 1/20 0.48

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
Hydrochloric Acid SCHEMBL741583 0.98 OPRM1 (0.47) OPRM1KMT2AMEN1CHRM2CHRM4
SCHEMBL19281773 0.98 OPRM1 (0.47) OPRM1KMT2AMEN1CHRM2CHRM4
Aminodiphenylmethane SCHEMBL9192661 0.91 ALDH1A1 (0.44) OPRM1KMT2AMEN1CHRM2CHRM4
SCHEMBL24238319 0.89 OPRM1 (0.54) OPRM1KMT2AMEN1CHRM2CHRM4
Hydrochloric Acid SCHEMBL5198335 0.89 OPRM1 (0.41) OPRM1KMT2AMEN1CHRM2CHRM4
SCHEMBL20133104 0.89 OPRM1 (0.54) OPRM1KMT2ACHRM2CHRM4CHRM5
SCHEMBL24238295 0.89 OPRM1 (0.41) OPRM1KMT2AMEN1CHRM2CHRM4
SCHEMBL24238338 0.89 OPRM1 (0.54) OPRM1KMT2AMEN1CHRM2CHRM4
SCHEMBL5745379 0.88 CYP2D6 (0.47) OPRM1KMT2AMEN1CHRM2CHRM4
SCHEMBL2267354 0.84 L3MBTL3 (0.53) OPRM1KMT2AMEN1CHRM2CHRM4

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 1524 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118356774-B Low-energy-consumption high-selectivity composite desulfurization solvent and preparation method thereof 江苏创新石化有限公司 2025-02-14 CN claimed
CN-115650893-B Synthesis method of 1-benzhydryl azetidine-3-one 南通华祥医药科技有限公司 2024-08-06 CN claimed
CN-118356774-A Low-energy-consumption high-selectivity composite desulfurization solvent and preparation method thereof 江苏创新石化有限公司 2024-07-19 CN claimed
CN-116943408-B Hindered amine composite desulfurizing agent and preparation method thereof 江苏创新石化有限公司 2024-01-30 CN claimed
CN-116943408-A Hindered amine composite desulfurizing agent and preparation method thereof 江苏创新石化有限公司 2023-10-27 CN claimed
CN-115650893-A Synthesis method of 1-benzhydrylazetidin-3-one 南通华祥医药科技有限公司 2023-01-31 CN claimed
CN-104292142-B A kind of de- aryl method of N- aryl-heterocyclic butane 天津大地康和医药技术有限公司 2019-05-14 CN claimed
CN-105461691-B A kind of preparation method of Azelnidipine 威海迪素制药有限公司 2019-01-11 CN claimed
CN-109053524-A A kind of preparation method of N-Boc-3- hydroxy azetidine 山东谛爱生物技术有限公司 2018-12-21 CN claimed
CN-106905212-A A kind of process for synthesizing the ketone of 1 dibenzo-p-methyl-aza-cyclobutane 3 上海昂提生物科技有限公司 2017-06-30 CN claimed
CN-105461691-A Preparation method of azelnidipine WEIHAI DISU PHARMACEUTICAL CO LTD 2016-04-06 CN claimed
CN-103130700-B Preparation method of azelnidipine intermediate SHENYANG J & HEALTH PHARAMACEUTICAL CO LTD 2015-04-29 CN claimed
CN-104292142-A Aryl removing method of N-aryl heterocyclic butane TIANJIN DADI KANGHE MEDICAL TECHNOLOGY CO LTD 2015-01-21 CN claimed
CN-103509003-A Preparation method of azelnidipine WEIHAI WEITAI PHARMACEUTICAL TECHNOLOGY DEV CO LTD 2014-01-15 CN claimed
CN-102329259-B Preparation method of (1-benzhydryl-3-azetidinol) cyanoacetate NANJING UNIVERSITY OF TECHNOLOGY 2013-09-18 CN claimed
CN-103130700-A Preparation method of azelnidipine intermediate SHENYANG J & HEALTH PHARMACEUTICAL CO LTD 2013-06-05 CN claimed
CN-102329259-A Preparation method of (1-benzhydryl-3-azetidinol) cyanoacetate NANJING UNIVERSITY OF TECHNOLOGY 2012-01-25 CN claimed
CN-101747249-A Method for preparing intermediate of azetidine-typed medicaments UNIV TONGJI 2010-06-23 CN claimed
CN-101676263-A Method for synthesizing N-tert-butoxycarbonyl group-3-hydroxy azetidine TIANJIN APPTEC CO LTD 2010-03-24 CN claimed
EP-0560905-B1 3-[2-CHLORO-4-(TRIFLUOROMETHYL)PHENOXY]-1-AZETIDINE CARBOXAMIDES HAVING ANTICONVULSANT ACTIVITY ROBINS CO INC A H (US) 1994-10-19 EP claimed