SCHEMBL7485233

SCHEMBL7485233

CCOC(=O)c1c(CCl)nc2sc(C)c(C)c2c1-c1ccc(OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.56
▸ ABCG2 Q9UNQ0 3/20 0.54
▸ GAA P10253 3/20 0.54
▸ POLB P06746 1/20 0.54
▸ ALDH1A1 P00352 8/20 0.52
▸ HPGD P15428 6/20 0.52
▸ KDM4E B2RXH2 5/20 0.51
▸ HTT P42858 1/20 0.49
▸ CYP2C9 P11712 3/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ STAT1 P42224 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ GRM6 O15303 1/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL7488242 0.90 MAPT (0.53) MAPTGAAPOLBALDH1A1HPGD
SCHEMBL7493208 0.87 SLC10A2 (0.50) MAPTABCG2GAAALDH1A1KDM4E
SCHEMBL7485972 0.87 MAPT (0.53) MAPTABCG2GAAPOLBALDH1A1
Diethylamine SCHEMBL7485977 0.83 ABCG2 (0.66) MAPTABCG2GAAPOLBALDH1A1
SCHEMBL7494845 0.81 PRKCI (0.48) MAPTPOLBALDH1A1HPGDKDM4E
SCHEMBL7494813 0.78 MAPT (0.44) MAPTGAAPOLBALDH1A1HPGD
SCHEMBL7484252 0.78 MAPT (0.49) MAPTABCG2POLBALDH1A1KDM4E
SCHEMBL7490064 0.77 POLB (0.44) MAPTGAAPOLBALDH1A1HPGD
SCHEMBL8806198 0.76 ALDH1A1 (0.44) MAPTGAAPOLBALDH1A1HPGD
SCHEMBL7485921 0.75 SLC10A2 (0.48) MAPTABCG2GAAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0791000-B1 THIENOPYRIDINE OR THIENOPYRIMIDINE DERIVATIVES AND THEIR USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-10-02 — — EP disclosed
US-5747486-A ANTIINFLAMMATORY AGENTS TAKEDA CHEMICAL INDUSTRIES (JP) 1998-05-05 — — US disclosed
EP-0791000-A1 THIENOPYRIDINE OR THIENOPYRIMIDINE DERIVATIVES AND THEIR USE Takeda Chemical Industries, Ltd. (JP) 1997-08-27 — — EP disclosed
WO-1996014319-A1 THIENOPYRIDINE OR THIENOPYRIMIDINE DERIVATIVES AND THEIR USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-17 — — WO disclosed
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