SCHEMBL9526037

SCHEMBL9526037

COC(=O)c1sc(OC)c(Cl)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.42
MAPT P10636 4/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
COMT P21964 1/20 0.40
KDM4E B2RXH2 5/20 0.36
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
MEN1 O00255 4/20 0.35
ALDH1A1 P00352 3/20 0.35
TRPM8 Q7Z2W7 1/20 0.34
HPGD P15428 3/20 0.34
LMNA P02545 2/20 0.33
GAA P10253 2/20 0.33
POLB P06746 1/20 0.33
NFKB1 P19838 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
SCHEMBL9525950 0.81 KMT2A (0.45) KMT2AMAPTTSHRHSD17B10COMT
SCHEMBL9826706 0.79 MAPT (0.44) KMT2AMAPTTSHRHSD17B10COMT
SCHEMBL9365836 0.79 MAPT (0.44) KMT2AMAPTTSHRHSD17B10KDM4E
SCHEMBL9827011 0.79 KMT2A (0.44) KMT2AMAPTTSHRHSD17B10COMT
SCHEMBL9524469 0.78 KMT2A (0.42) KMT2AMAPTTSHRHSD17B10COMT
SCHEMBL9826894 0.78 MAPT (0.47) KMT2AMAPTTSHRHSD17B10KDM4E
SCHEMBL1086028 0.75 KMT2A (0.56) KMT2AMAPTTSHRHSD17B10COMT
SCHEMBL1720659 0.73 KMT2A (0.54) KMT2AMAPTTSHRHSD17B10COMT
SCHEMBL1086031 0.68 MAPT (0.48) KMT2AMAPTTSHRHSD17B10KDM4E
SCHEMBL20439943 0.68

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
EP-0297697-B1 Thiophene-2-carboxamide derivatives and their pharmaceutical use LILLY SA (ES) 1993-12-29 EP disclosed
US-4904686-A 3-ALKOXYTHIOPHENE-2-CARBOXAMIDES; CENTRAL NERVOUS SYSTEM DISORDERS LILLY INDUSTRIES LIMITED (GB) 1990-02-27 US disclosed
EP-0297697-A1 Thiophene-2-carboxamide derivatives and their pharmaceutical use LILLY S.A. (ES) 1989-01-04 EP disclosed