SCHEMBL6496327

SCHEMBL6496327

CCSc1ccc(Cl)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
DAO P14920 1/20 0.41
AHR P35869 1/20 0.39
SLC6A4 P31645 3/20 0.38
MAOA P21397 1/20 0.38
HAO1 Q9UJM8 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
FBP1 P09467 1/20 0.37
IDO1 P14902 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL3785770 0.83 SLC6A4 (0.36) SLC6A4MAOATDP1HSD17B10CYP1A2
SCHEMBL3781466 0.83 PDE7A (0.37) SLC6A4MAOA
SCHEMBL12749869 0.83 CYP3A4 (0.43) SLC6A4MAOANPSR1CYP3A4MAPT
SCHEMBL9515929 0.81 TDP1 (0.45) TP53DAOAHRHAO1TDP1
SCHEMBL3786473 0.81 TSHR (0.50) TP53SLC6A4MAOACYP3A4TSHR
SCHEMBL2652648 0.81 TSHR (0.41) SLC6A4MAOAHTTNPSR1TSHR
SCHEMBL707892 0.81 ALDH1A1 (0.39) SLC6A4MAOACYP3A4LMNAMAPT
SCHEMBL29992857 0.81 ALDH1A1 (0.39) SLC6A4MAOACYP3A4LMNAMAPT
SCHEMBL3723662 0.81 HSD17B10 (0.50) DAOSLC6A4TDP1HTTIDO1
SCHEMBL3793113 0.81 TSHR (0.50) TP53SLC6A4MAOATDP1CYP3A4

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
EP-3472165-B1 N-(SUBSTITUTED-PHENYL)-SULFONAMIDE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2023-09-06 EP disclosed
WO-2005016883-A2 ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF ICOS CORPORATION (US) 2005-02-24 WO disclosed