SCHEMBL20737987

SCHEMBL20737987

C=CCn1c(=O)n(Cl)c(=O)n(CC=C)c1=O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.76
NPSR1 Q6W5P4 1/20 0.52
CYP1A2 P05177 2/20 0.44
CYP2D6 P10635 1/20 0.44
ADORA2B P29275 4/20 0.42
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ADORA2A P29274 3/20 0.40
MAPT P10636 2/20 0.39
GAA P10253 2/20 0.37
PLA2G4A P47712 2/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
USP2 O75604 1/20 0.34
KDM4E B2RXH2 3/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 1/20 0.33
ADORA3 P0DMS8 2/20 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
SCHEMBL28662 0.87 CYP3A4 (1.00) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL18368139 0.80 CYP3A4 (0.84) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL10799429 0.80 CYP3A4 (0.84) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL18194710 0.78 CYP3A4 (0.80) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL11033311 0.77 CYP3A4 (0.70) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL2610821 0.77 CYP3A4 (0.70) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL2619204 0.77 CYP3A4 (0.70) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL10801904 0.77 CYP3A4 (0.70) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL10997976 0.77 CYP3A4 (0.79) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B
SCHEMBL24669059 0.76 CYP3A4 (0.76) CYP3A4NPSR1CYP1A2CYP2D6ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10788750-B2 Photosensitive resin composition, cured film, laminate, touch panel member, and method for manufacturing cured film TORAY INDUSTRIES, INC. (JP) 2020-09-29 US disclosed
US-20190049840-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, LAMINATE, TOUCH PANEL MEMBER, AND METHOD FOR MANUFACTURING CURED FILM TORAY INDUSTRIES, INC. (JP) 2019-02-14 US disclosed