SCHEMBL9425818

SCHEMBL9425818

COC(=O)c1sc2c(c1N)CN(C(C)=O)CC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.47
KDM4E B2RXH2 6/20 0.47
GAA P10253 3/20 0.47
HSD17B10 Q99714 2/20 0.47
BPTF Q12830 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
EP300 Q09472 3/20 0.41
CREBBP Q92793 3/20 0.41
MAPT P10636 7/20 0.40
HPGD P15428 4/20 0.40
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
BRD4 O60885 1/20 0.38
TP53 P04637 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL623383 0.85 MAPT (0.52) ALDH1A1KDM4EGAAHSD17B10L3MBTL1
SCHEMBL622747 0.84 ADORA1 (0.52) ALDH1A1KDM4EGAAHSD17B10MAPT
SCHEMBL22392265 0.83 ALDH1A1 (0.46) ALDH1A1KDM4EGAAHSD17B10L3MBTL1
SCHEMBL8093726 0.82 KDM4E (0.41) ALDH1A1KDM4EGAAHSD17B10BPTF
SCHEMBL9437227 0.82 DRD4 (0.46) ALDH1A1KDM4EGAAHSD17B10MEN1
SCHEMBL22392258 0.78 MEN1 (0.56) ALDH1A1GAAHSD17B10MEN1KMT2A
SCHEMBL9722794 0.75 ALDH1A1 (0.50) ALDH1A1KDM4EGAAHSD17B10MEN1
SCHEMBL623301 0.75 MAPT (0.49) ALDH1A1KDM4EGAAHSD17B10L3MBTL1
SCHEMBL624102 0.74 ADORA1 (0.49) ALDH1A1KDM4EGAAHSD17B10MEN1
SCHEMBL20665903 0.74 ADORA1 (0.61) ALDH1A1KDM4EGAAHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5296603-A 3-amino-5-o-chlorobenzyl-4,5,6,7-tetrahydrothieno[3,2-c]-pyridine-2-carboxylic acid compounds FUJI PHOTO FILM CO., LTD. (JP) 1994-03-22 US disclosed
EP-0573955-A1 3-Amino-5-o-chlorobenzyl-4,5,6,7-tetrahydrothieno[3,2-c]-pyridine-2-carboxylic acid derivative and process for producing the same FUJI PHOTO FILM CO., LTD. (JP) 1993-12-15 EP disclosed
EP-0573975-A1 2-alkoxycarbonyl-5-o-chlorobenzyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine derivative and process for producing the same FUJI PHOTO FILM CO., LTD. (JP) 1993-12-15 EP disclosed