SCHEMBL10801414

SCHEMBL10801414

Cc1ccc(C2NC(c3ccc(C)cc3)C(c3ccc(C)cc3)NC2c2ccc(C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
ATM Q13315 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
ACHE P22303 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CHRNA7 P36544 1/20 0.35

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
SCHEMBL29086412 0.90 MAPT (0.55) MAPTATMNPSR1CYP1A2CYP3A4
SCHEMBL9279987 0.83 MAPT (0.59) MAPTATMNPSR1CYP1A2CYP3A4
SCHEMBL9279991 0.83 MAPT (0.59) MAPTATMNPSR1CYP1A2CYP3A4
SCHEMBL9279981 0.83 MAPT (0.59) MAPTATMNPSR1CYP1A2CYP3A4
SCHEMBL3258110 0.74 HTT (0.49) MAPTATMNPSR1CYP1A2CYP3A4
SCHEMBL3258108 0.74 HTT (0.49) MAPTATMNPSR1CYP1A2CYP3A4
SCHEMBL16610427 0.72 MAPT (0.43) MAPTATMNPSR1CYP1A2CYP3A4
SCHEMBL5427539 0.71 MAPT (0.47) MAPTATMNPSR1CYP1A2CYP3A4
SCHEMBL10350394 0.71 NPSR1 (0.50) MAPTATMNPSR1ACHETDP1
SCHEMBL12232396 0.70 MAPT (0.42) MAPTATMNPSR1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4695383-A COPOLYAMIDE FROM A DIAMINODIPHENYL SULFONE TOYO BOSEKI KABUSHIKI KAISHA (JP) 1987-09-22 US disclosed