SCHEMBL47779

SCHEMBL47779

O=C(OCCc1cccc(Cl)c1Cl)OCCc1cccc(Cl)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.52
PNMT P11086 1/20 0.47
IDO1 P14902 2/20 0.46
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
PARP2 Q9UGN5 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
CTSG P08311 1/20 0.39
CMA1 P23946 1/20 0.39
PTPRC P08575 1/20 0.39
PTPRG P23470 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37

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
SCHEMBL4590126 0.86 TAAR1 (0.53) TAAR1PNMTIDO1TSHRSMN1; SMN2
SCHEMBL2345808 0.81 IDO1 (0.58) TAAR1PNMTIDO1TSHRSMN1; SMN2
SCHEMBL3897629 0.78 KMT2A (0.49) TAAR1PNMTIDO1TSHRSMN1; SMN2
SCHEMBL3591795 0.77 TAAR1 (0.46) TAAR1PNMTIDO1TSHRSMN1; SMN2
SCHEMBL24822382 0.76 TAAR1 (0.57) TAAR1PNMTIDO1TSHRSMN1; SMN2
SCHEMBL5544906 0.75 TAAR1 (0.52) TAAR1PNMTIDO1SMN1; SMN2NPSR1
SCHEMBL5544911 0.75 TAAR1 (0.52) TAAR1PNMTIDO1TSHRSMN1; SMN2
SCHEMBL4699564 0.74 TAAR1 (0.55) TAAR1PNMTTSHRSMN1; SMN2NPSR1
SCHEMBL4607557 0.74 IDO1 (0.58) TAAR1PNMTIDO1TSHRSMN1; SMN2
SCHEMBL11349111 0.74 TAAR1 (0.55) TAAR1PNMTIDO1TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2149586-B1 AMINE EPOXY RESIN CURING AGENT, GAS BARRIER EPOXY RESIN COMPOSITION COMPRISING THE CURING AGENT, COATING AGENT, AND ADHESIVE AGENT FOR LAMINATE MITSUBISHI GAS CHEMICAL CO (JP) 2018-01-03 EP disclosed
US-8128782-B2 Amine epoxy resin curing agent, gas barrier epoxy resin composition comprising the curing agent, coating agent, and adhesive agent for laminate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-03-06 US disclosed
US-20100160494-A1 AMINE EPOXY RESIN CURING AGENT, GAS BARRIER EPOXY RESIN COMPOSITION COMPRISING THE CURING AGENT, COATING AGENT, AND ADHESIVE AGENT FOR LAMINATE MITSUBISHI GAS CHEMICAL COMPANY INC. (JP) 2010-06-24 US disclosed
EP-2149586-A1 AMINE EPOXY RESIN CURING AGENT, GAS BARRIER EPOXY RESIN COMPOSITION COMPRISING THE CURING AGENT, COATING AGENT, AND ADHESIVE AGENT FOR LAMINATE Mitsubishi Gas Chemical Company, Inc. (JP) 2010-02-03 EP disclosed