SCHEMBL1262270

SCHEMBL1262270

C=CC(=O)NCc1ccccc1.CCCNCCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 2/20 0.54
▸ ALDH1A1 P00352 3/20 0.51
▸ CYP2C19 P33261 3/20 0.51
▸ LMNA P02545 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C9 P11712 2/20 0.51
▸ MMP1 P03956 2/20 0.49
▸ MMP2 P08253 2/20 0.49
▸ MMP9 P14780 2/20 0.49
▸ CYP3A4 P08684 2/20 0.47
▸ EPHX2 P34913 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ HDAC3 O15379 2/20 0.46
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC2 Q92769 2/20 0.46
▸ NCOR2 Q9Y618 1/20 0.46
▸ RIPK1 Q13546 1/20 0.45
▸ EPHX1 P07099 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ EGFR P00533 1/20 0.44

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
SCHEMBL1262788 0.91 EPHX2 (0.51) TGM2ALDH1A1CYP2C19LMNACYP2D6
Diethylamine SCHEMBL1263580 0.88 TGM2 (0.57) TGM2ALDH1A1CYP2C19LMNACYP2D6
SCHEMBL40744 0.87 TGM2 (0.68) TGM2ALDH1A1CYP2C19LMNACYP2D6
Dimethylamine SCHEMBL1263583 0.85 TGM2 (0.62) TGM2ALDH1A1CYP2C19LMNACYP2D6
Ethylene SCHEMBL6400166 0.85 TGM2 (0.66) TGM2ALDH1A1CYP2C19LMNACYP2D6
Acrylamide SCHEMBL28802284 0.81 TGM2 (0.60) TGM2ALDH1A1CYP2C19LMNACYP2D6
SCHEMBL8838968 0.81 TGM2 (0.60) TGM2ALDH1A1CYP2C19LMNACYP2D6
Phenol SCHEMBL28345445 0.81 MMP1 (0.60) TGM2ALDH1A1CYP2C19LMNACYP2D6
SCHEMBL1262280 0.78 TGM2 (0.71) TGM2ALDH1A1CYP2C19LMNAHDAC3
SCHEMBL11775423 0.78 TGM2 (0.71) TGM2ALDH1A1CYP2C19LMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7881648-B2 Positive charge control resin for electrophotographic functional component parts, developing roller, and electrophotographic apparatus CANON KASEI KABUSHIKI KAISHA (JP) 2011-02-01 — — US disclosed
US-20080247787-A1 Positive Charge Control Resin for Electrophotographic Functional Component Parts, Developing Roller, and Electrophotographic Apparatus CANON KASEI KABUSHIKI KAISHA (JP) 2008-10-09 — — US disclosed
WO-2006134788-A1 POSITIVE CHARGE CONTROL RESIN FOR ELECTROPHOTOGRAPHIC FUNCTIONAL COMPONENT PARTS, DEVELOPING ROLLER, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KASEI KABUSHIKI KAISHA (JP) 2006-12-21 — — WO disclosed
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