SCHEMBL9514915

SCHEMBL9514915

COC(=O)c1ccc2sc(/C=C/c3cccc(N)c3)nc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ P4HB P07237 3/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ PIK3CA P42336 1/20 0.39
▸ PIK3CB P42338 1/20 0.39
▸ PIK3CG P48736 1/20 0.39
▸ PI4KB Q9UBF8 1/20 0.39
▸ CLK1 P49759 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ CYP19A1 P11511 2/20 0.38
▸ PTPN1 P18031 1/20 0.38

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
SCHEMBL9514917 1.00 MAPT (0.42) MAPTKMT2ARAB9AMEN1KDM4E
SCHEMBL9514542 0.83 MEN1 (0.56) MAPTKMT2ARAB9AMEN1ALDH1A1
SCHEMBL9514551 0.83 MEN1 (0.56) MAPTKMT2ARAB9AMEN1ALDH1A1
SCHEMBL9337056 0.83 KAT8 (0.48) MAPTKMT2ARAB9AMEN1KDM4E
SCHEMBL9334957 0.83 KAT8 (0.48) MAPTKMT2ARAB9AMEN1KDM4E
SCHEMBL9337075 0.83 KAT8 (0.48) MAPTKMT2ARAB9AMEN1KDM4E
SCHEMBL9389070 0.83 KAT8 (0.48) MAPTKMT2ARAB9AMEN1KDM4E
SCHEMBL7898872 0.77 PTPN1 (0.61) MAPTKMT2ARAB9AMEN1KDM4E
SCHEMBL9335180 0.77 KAT8 (0.50) MAPTKMT2ARAB9AMEN1KDM4E
SCHEMBL9335185 0.77 KAT8 (0.50) MAPTKMT2ARAB9AMEN1KDM4E

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-0219436-B1 Thiazole derivative and leukotriene antagonist containing the same as the effective ingredients MITSUBISHI CHEM IND (JP) 1993-12-22 — — EP disclosed
US-4902700-A Thiazole derivative and leukotriene antagonist containing the same as the effective ingredients MITSUBISHI KASEI CORPORATION (JP) 1990-02-20 — — US disclosed
EP-0219436-A2 Thiazole derivative and leukotriene antagonist containing the same as the effective ingredients MITSUBISHI KASEI CORPORATION (JP) 1987-04-22 — — EP disclosed
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