SCHEMBL6565246

SCHEMBL6565246

CCCCN(CCCC)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.47
ERBB2 P04626 1/20 0.47
KCNH2 Q12809 10/20 0.47
NR1H2 P55055 4/20 0.46
NR1H3 Q13133 4/20 0.46
CNR2 P34972 3/20 0.46
NR1I2 O75469 1/20 0.40

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
SCHEMBL28598991 0.92 CNR2 (0.54) EGFRERBB2KCNH2CNR2
SCHEMBL11029155 0.89 CNR2 (0.44) EGFRERBB2KCNH2NR1H2NR1H3
SCHEMBL7153351 0.89 EGFR (0.50) EGFRERBB2NR1H2NR1H3CNR2
SCHEMBL7790003 0.86 CNR2 (0.46) EGFRERBB2KCNH2CNR2
SCHEMBL17663681 0.84 EGFR (0.47) EGFRERBB2NR1H2NR1H3CNR2
SCHEMBL2014159 0.84 EGFR (0.47) EGFRERBB2NR1H2NR1H3CNR2
SCHEMBL768272 0.84 EGFR (0.47) EGFRERBB2NR1H2NR1H3CNR2
SCHEMBL3347146 0.82 CNR2 (0.47) EGFRERBB2KCNH2NR1H2NR1H3
SCHEMBL3054212 0.82 EGFR (0.46) EGFRERBB2NR1H2NR1H3CNR2
SCHEMBL1459455 0.81 EGFR (0.44) EGFRERBB2NR1H2NR1H3CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110066383-A A kind of aqueous epoxy curing agent of ionic and its preparation method and application 万华化学集团股份有限公司 2019-07-30 CN disclosed
US-10040949-B2 Thermosetting powder coating material and coated article FUJI XEROX CO., LTD. (JP) 2018-08-07 US disclosed
CN-108285526-A A kind of modified alicyclic ring amine hardener and preparation method thereof 万华化学集团股份有限公司 2018-07-17 CN disclosed
US-20160280930-A1 THERMOSETTING POWDER COATING MATERIAL AND COATED ARTICLE FUJIFILM BUSINESS INNOVATION CORP. (JP) 2016-09-29 US disclosed
EP-0835891-B1 Water-dispersible blocked isocyanate composition, and water-base paint composition and water base adhesive composition using the same NIPPON POLYURETHANE KOGYO KK (JP) 2004-03-31 EP disclosed
US-6080812-A TRIMERIZING A DIISOCYANATE-DIOL-DIISOCYANATE CONDENSATION PRODUCT TO FORM ISOCYANURATE MACROMOLECULAR MONOMER, REACTING WITH HYDROPHILIC SURFACTANT TO FORM A URETHANE/ISOCYANURATE COPOLYMER, THEN BLOCKING REMAINING ISOCYANATE GROUPS NIPPON POLYURETHANE INDUSTRY C. LTD. (JP) 2000-06-27 US disclosed
US-5998539-A ISOCYANATE BLOCKED WITH AN ALCOHOL NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) 1999-12-07 US disclosed
EP-0835891-A1 Water-dispersible blocked isocyanate composition, and water-base paint composition and water base adhesive composition using the same Nippon Polyurethane Industry Co. Ltd. (JP) 1998-04-15 EP disclosed