SCHEMBL6676537

SCHEMBL6676537

COc1ccc(CNC(N)=S)cc1OC

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.71
ALDH1A1 P00352 2/20 0.68
MAPT P10636 2/20 0.59
POLB P06746 2/20 0.56
MEN1 O00255 2/20 0.56
LMNA P02545 1/20 0.56
MAPK1 P28482 1/20 0.56
TSHR P16473 1/20 0.55
MAPK10 P53779 1/20 0.55
KDM4E B2RXH2 1/20 0.54
EPHX2 P34913 1/20 0.54
CA2 P00918 1/20 0.53
TDP1 Q9NUW8 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL2846850 0.89 PTPN7 (0.58) KMT2AMAPK1TSHR
SCHEMBL29828592 0.89 PTPN7 (0.58) KMT2AMAPK1TSHR
SCHEMBL2847686 0.87 TTR (0.58) KMT2AALDH1A1MAPTMEN1LMNA
SCHEMBL2865800 0.86 KMT2A (0.56) KMT2AALDH1A1MAPTPOLBLMNA
SCHEMBL2846389 0.85 KMT2A (0.54) KMT2AALDH1A1MAPTPOLBMEN1
SCHEMBL6673419 0.84 BCHE (0.61) KMT2AALDH1A1MAPTLMNAMAPK1
SCHEMBL7026447 0.83 PDE4B (0.58) KMT2AALDH1A1MEN1EPHX2
SCHEMBL20915765 0.83 TSHR (0.55) KMT2AALDH1A1POLBMEN1TSHR
SCHEMBL1186351 0.83 ALDH1A1 (0.68) KMT2AALDH1A1MAPTPOLBTSHR
SCHEMBL2846636 0.83 ALDH1A1 (0.78) KMT2AALDH1A1POLBMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202628-B1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2004-10-13 EP disclosed
EP-1202628-A4 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2002-10-30 EP disclosed
EP-1202628-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS Euro-Celtique S.A. (LU) 2002-05-08 EP disclosed
WO-2001011967-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2001-02-22 WO disclosed
US-4735957-A ANTIULCER AGENTS, CARDIOTONIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-04-05 US disclosed
US-4649146-A ANTIULCER FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-03-10 US disclosed
EP-0117082-A2 Thiazole derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-08-29 EP disclosed