SCHEMBL6197705

SCHEMBL6197705

COc1ccc(-c2nc(-c3ccc(N(C(C)=O)C(C)=O)cc3)cs2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.58
▸ MEN1 O00255 6/20 0.57
▸ KMT2A Q03164 6/20 0.57
▸ RAB9A P51151 3/20 0.57
▸ SMN1; SMN2 Q16637 3/20 0.57
▸ MAPT P10636 3/20 0.57
▸ POLB P06746 3/20 0.57
▸ GAA P10253 2/20 0.57
▸ KDM4E B2RXH2 5/20 0.56
▸ HPGD P15428 1/20 0.56
▸ ALOX15 P16050 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ NPC1 O15118 2/20 0.53
▸ HTT P42858 1/20 0.53
▸ PLAU P00749 2/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ TLR7 Q9NYK1 1/20 0.48
▸ ECE1 P42892 1/20 0.47
▸ CYP1A1 P04798 3/20 0.47

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
SCHEMBL6198667 0.83 ALDH1A1 (0.72) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6198574 0.82 ALDH1A1 (0.76) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6197622 0.80 ALDH1A1 (0.65) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL4279626 0.79 ALOX5 (0.64) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6200175 0.78 ALDH1A1 (0.70) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6197689 0.78 MEN1 (0.67) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6200582 0.78 PTGS2 (0.59) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6198837 0.77 ALDH1A1 (0.56) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL7671545 0.77 MEN1 (0.55) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL6202609 0.76 ALDH1A1 (0.62) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1130017-B1 Azole derivatives and their use as superoxide radical inhibitors OTSUKA PHARMA CO LTD (JP) 2005-06-15 — — EP disclosed
EP-0934937-B1 Azole derivatives as superoxide radical inhibitor OTSUKA PHARMA CO LTD (JP) 2002-02-27 — — EP disclosed
US-RE37556-E1 (ALKOXYPHENYL)THIAZOLE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2002-02-19 — — US disclosed
EP-1130017-A2 Azole derivatives and their use as superoxide radical inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2001-09-05 — — EP disclosed
US-6080764-A PROTECTING VARIOUS TISSUE CELLS FROM DISTURBANCES ASSOCIATED WITH ISCHEMIA AND BLOOD REPERFUSION IN HEART, BRAIN, KIDNEY, LUNG AND DIGESTIVE TRACT BY INHIBITING SUPEROXIDE-RELEASE BY NEUTROPHILIC LEUKOCYTES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-06-27 — — US disclosed
EP-0934937-A1 Azole derivatives as superoxide radical inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1999-08-11 — — EP disclosed
US-5677319-A THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 — — US disclosed
US-5643932-A PREVENTS CELL DAMAGE AFTER ISCHEMIA AND RE-PERFUSION, SUBSTITUTED THIAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 — — US disclosed
EP-0513387-A1 ACTIVE OXYGEN INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-19 — — EP disclosed
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