SCHEMBL2199217

SCHEMBL2199217

CC(C#N)C1CNCCO1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 16/20 0.38
SLC6A4 P31645 16/20 0.38
SLC6A3 Q01959 11/20 0.38
HRH1 P35367 3/20 0.34
MLNR O43193 1/20 0.33
ADRB2 P07550 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR2C P28335 1/20 0.33
OPRK1 P41145 1/20 0.33
KCNH2 Q12809 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33

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
Morpholine SCHEMBL27525337 0.93 MEN1 (0.35) SLC6A2SLC6A4SLC6A3HRH1MLNR
SCHEMBL17956739 0.85 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3HRH1MLNR
Morpholine SCHEMBL27550558 0.85 SLC6A2 (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL6444451 0.81 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3HRH1MLNR
SCHEMBL28253319 0.80 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3HRH1MLNR
SCHEMBL11572913 0.77 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3HRH1MLNR
Fluoride SCHEMBL28166838 0.77 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3HRH1MLNR
SCHEMBL12206944 0.77
SCHEMBL12206943 0.77
SCHEMBL516648 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101824008-B Preparation method of N, N-dimethyl aminopropyl morpholine ZHANGJIAGANG CITY DAWEI ASSISTANTS INDUSTRY CO LTD 2012-05-30 CN claimed
CN-101824008-A Preparation method of N,N-dimethyl aminopropyl morpholine ZHANGJIAGANG CITY DAWEI ASSISTANTS INDUSTRY CO LTD 2010-09-08 CN claimed
CN-1286825-C Method for preparing N-amino propyl morpholine JIHUA GROUP CO (CN) 2006-11-29 CN claimed
CN-1660825-A Method for preparing N-amino propyl morpholine JIHUA GROUP CO (CN) 2005-08-31 CN claimed
US-4304818-A POLYISOCYANURATE-OXAZOLIDONES FROM POLYISOCYANATE AND POLYEPOXIDE HITACHI, LTD. (JP) 1981-12-08 US claimed
US-3979365-A FROM A POLYOXAZOLIDINE PREPOLYMER AND POLYISOCYANATE HITACHI, LTD. (JA) 1976-09-07 US claimed
CN-103333275-B With the polymkeric substance of functionalized with nitrile compounds comprising protected amino BRIDGESTONE CO., LTD. (JP) 2015-07-29 CN disclosed
CN-103025816-B Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2015-07-22 CN disclosed
CN-103333275-A Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2013-10-02 CN disclosed
CN-102361887-B Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2013-06-26 CN disclosed
CN-103025816-A Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORP 2013-04-03 CN disclosed
CN-101824008-B Preparation method of N, N-dimethyl aminopropyl morpholine ZHANGJIAGANG CITY DAWEI ASSISTANTS INDUSTRY CO LTD 2012-05-30 CN disclosed
US-7977434-B2 Reaction product of polyalkyleneimine with hydrogen cyanide and formaldehyde; reduced fiber affinity and damage; handling safety; textile and paper bleaching BASF AKTIENGESELLSCHAFT (DE) 2011-07-12 US disclosed
WO-2003002705-A1 PREPARATION OF CELLULOSIC MATERIALS NOVOZYMES NORTH AMERICA, INC. (US) 2003-01-09 WO disclosed
US-4975228-A MIXING WITH SOLVENT,HEATING, EXTRUSION, QUENCHING THE DOW CHEMICAL COMPANY (US) 1990-12-04 US disclosed
US-4955993-A MADE FROM HYDROPHOBIC POLYMERS, FOR SEPARATION OF GASES THE DOW CHEMICAL COMPANY (US) 1990-09-11 US disclosed
US-4772392-A EXTRUSION FROM MIXTURE OF SOLVENT AND NONSOLVENT THE DOW CHEMICAL COMPANY (US) 1988-09-20 US disclosed
US-4304818-A POLYISOCYANURATE-OXAZOLIDONES FROM POLYISOCYANATE AND POLYEPOXIDE HITACHI, LTD. (JP) 1981-12-08 US disclosed
US-4070416-A POLYFUNCTIONAL ISOCYANATES AND EPOXIDES, ISOCYANURATE-OXAZOLIDOLE POLYMERS HITACHI, LTD. (JA) 1978-01-24 US disclosed
US-3979365-A FROM A POLYOXAZOLIDINE PREPOLYMER AND POLYISOCYANATE HITACHI, LTD. (JA) 1976-09-07 US disclosed