SCHEMBL4730301

SCHEMBL4730301

CSc1ccccc1-c1ccccc1NC(=O)Oc1sc(C)nc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.40
ALDH1A1 P00352 5/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KMT2A Q03164 3/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.34
POLB P06746 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 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
SCHEMBL4732011 0.84 ALDH1A1 (0.37) MAPTALDH1A1L3MBTL1KMT2AHPGD
SCHEMBL2905171 0.84 CHRM3 (0.42) MAPTKMT2AKDM4EMEN1GAA
SCHEMBL4733535 0.84 MAPT (0.41) MAPTALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL4734232 0.82 MAPT (0.41) MAPTALDH1A1L3MBTL1KMT2AHSD17B10
SCHEMBL2911519 0.81 CHRM3 (0.43) MAPTALDH1A1HSD17B10POLBNPSR1
SCHEMBL4732975 0.79 CA12 (0.44) MAPTKMT2AKDM4EMEN1POLB
SCHEMBL4730702 0.79 MAPT (0.41) MAPTALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL4802060 0.78 MAPT (0.37) MAPTALDH1A1L3MBTL1KMT2AHPGD
SCHEMBL4730073 0.76 CA2 (0.39) ALDH1A1KMT2AMEN1POLBHTT
SCHEMBL4599063 0.76 TSHR (0.43) MAPTALDH1A1L3MBTL1KMT2AKDM4E

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
WO-2008053044-A2 HETARYL CARBON ACID-N-(BIPHEN-2-YL)AMIDE COMPOUNDS BASF SE (DE) 2008-05-08 WO claimed
WO-2008053044-A2 HETARYL CARBON ACID-N-(BIPHEN-2-YL)AMIDE COMPOUNDS BASF SE (DE) 2008-05-08 WO disclosed