SCHEMBL9736809

SCHEMBL9736809

CSc1ccc(NC(=O)NC(=O)c2c(Cl)cccc2Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.53
MAPT P10636 6/20 0.51
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
CYP3A4 P08684 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
NOX1 Q9Y5S8 1/20 0.49
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
TAS1R2 Q8TE23 1/20 0.47
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
TYK2 P29597 1/20 0.47
KDM4E B2RXH2 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46

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
SCHEMBL11351845 0.85 KMT2A (0.48) PTGS2MAPTKMT2AMEN1CYP3A4
SCHEMBL9348852 0.84 KMT2A (0.46) MAPTKMT2AMEN1CYP3A4RAB9A
SCHEMBL9352624 0.84 NPC1 (0.50) MAPTKMT2AMEN1CYP3A4CYP1A2
Dichlorbenzuron SCHEMBL3663126 0.83 CNR1 (0.54) KMT2AMEN1CYP3A4RAB9ANPC1
SCHEMBL9348629 0.82 NPC1 (0.48) MAPTKMT2AMEN1CYP3A4RAB9A
SCHEMBL9702804 0.82 MAPT (0.59) MAPTKMT2AMEN1CYP3A4CYP1A2
SCHEMBL9737557 0.82 MAPT (0.49) MAPTKMT2AMEN1CYP3A4CYP1A2
SCHEMBL11244841 0.82 MAOA (0.51) MAPTKMT2AMEN1CYP3A4RAB9A
SCHEMBL7605864 0.82 KMT2A (0.61) MAPTKMT2AMEN1CYP3A4RAB9A
SCHEMBL7603611 0.81 RAB9A (0.50) MAPTKMT2AMEN1CYP3A4RAB9A

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-5142064-A Larvicides has benzoyl or thiobenzoyl group DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1992-08-25 US claimed