SCHEMBL7096960

SCHEMBL7096960

Cn1c(=O)[nH]c(=O)c2cc(C(=O)NCc3ccccc3Cl)sc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
SMN1; SMN2 Q16637 4/20 0.49
TP53 P04637 1/20 0.49
MALT1 Q9UDY8 2/20 0.48
ALDH1A1 P00352 5/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4E B2RXH2 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
HPGD P15428 2/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
POLB P06746 2/20 0.45
GFER P55789 1/20 0.44
ROCK2 O75116 1/20 0.44
LMNA P02545 2/20 0.43

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
SCHEMBL6239569 0.80 KDM4E (0.49) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL6724869 0.79 TRPA1 (0.54) MAPTSMN1; SMN2TP53ALDH1A1MEN1
SCHEMBL6256414 0.79 MAPT (0.47) MAPTSMN1; SMN2TP53ALDH1A1KDM4E
SCHEMBL7031009 0.77 MAPT (0.63) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL6254956 0.77 MAPT (0.56) MAPTTP53MALT1ALDH1A1KDM4E
SCHEMBL6237897 0.74 KDM4E (0.45) MAPTSMN1; SMN2ALDH1A1TSHRKDM4E
SCHEMBL6254208 0.71 KDM4E (0.43) MAPTSMN1; SMN2ALDH1A1PKMMEN1
SCHEMBL6253952 0.71 MAPT (0.48) MAPTTP53ALDH1A1PKMTSHR
SCHEMBL6727884 0.71 TRPA1 (0.54) MAPTTP53
SCHEMBL6237834 0.70 HSD17B10 (0.45) MAPTALDH1A1TSHRKMT2AKDM4E

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-1370562-A1 THIENO[2,3-D]PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-12-17 EP claimed
WO-2002064598-A1 THIENO'2,3-D PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 WO claimed