SCHEMBL5158355

SCHEMBL5158355

O=C(/C=C\C(=O)NCc1ccccc1)NCc1ccccc1

nearest known ligand 0.89

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.89
LMNA P02545 2/20 0.89
CYP2D6 P10635 2/20 0.89
CYP2C19 P33261 2/20 0.89
MMP1 P03956 4/20 0.76
MMP2 P08253 4/20 0.76
MMP9 P14780 4/20 0.76
SMN1; SMN2 Q16637 1/20 0.63
CYP2C9 P11712 2/20 0.62
KDM4E B2RXH2 2/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
POLB P06746 1/20 0.59
TAAR1 Q96RJ0 2/20 0.59
GAA P10253 1/20 0.57
HTT P42858 1/20 0.55
CYP1A2 P05177 1/20 0.55
TSHR P16473 1/20 0.55

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
SCHEMBL10336384 1.00 ALDH1A1 (0.89) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL27311354 1.00 ALDH1A1 (0.89) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL4021288 0.94 ALDH1A1 (1.00) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL4021293 0.94 ALDH1A1 (1.00) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL5175917 0.94 ALDH1A1 (1.00) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL4864068 0.91 ALDH1A1 (0.74) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL5175679 0.91 ALDH1A1 (0.74) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL4864073 0.91 ALDH1A1 (0.74) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL23252469 0.88 ALDH1A1 (0.71) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL2024199 0.88 ALDH1A1 (0.71) ALDH1A1LMNACYP2D6CYP2C19MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1640389-B1 Copolymers, their process and use as dipersant or wetting agent BYK CHEMIE GMBH (DE) 2007-02-07 EP disclosed
EP-1640389-A1 Copolymers, their process and use as dipersant or wetting agent Byk-Chemie GmbH (DE) 2006-03-29 EP disclosed
EP-0812824-B1 Process for preparing N-substituted maleimides DAIHACHI CHEM IND (JP) 2001-04-04 EP disclosed
US-5741913-A REACTING MALEIC ANHYDRIDE WITH A PRIMARY AMINE IN MIXTURE OF PROTIC POLAR AND NONPOLAR SOLVENTS IN PRESENCE OF ACID CATALYST AND POLYMERIZATION INHIBITOR, EFFICIENCY DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 1998-04-21 US disclosed
EP-0812824-A1 Process for preparing N-substituted maleimides DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) 1997-12-17 EP disclosed
US-4990428-A Photopolymerizable compound overcoating aluminum(or alloy therof), and aluminum oxide layers MITSUBISHI KASEI CORPORATION (JP) 1991-02-05 US disclosed
US-4933268-A OXONOL DYE HAVING PYRAZOLONE NUCLEUS FUJI PHOTO FILM CO., LTD. (JP) 1990-06-12 US disclosed
EP-0179448-B1 PHOTOSENSITIVE PLANOGRAPHIC PRINTING PLATE MITSUBISHI KASEI CORPORATION (JP) 1990-04-18 EP disclosed
EP-0316013-A2 Silver halide photographic material having at least one dyed hydrophilic colloid layer Fuji Photo Film Co., Ltd. (JP) 1989-05-17 EP disclosed
EP-0179448-A2 Photosensitive planographic printing plate MITSUBISHI KASEI CORPORATION (JP) 1986-04-30 EP disclosed