SCHEMBL9002285

SCHEMBL9002285

CS(=O)(=O)NCCSc1cccc2nc(N3C(=O)CCC3=O)c(Cl)n12

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 2/20 0.37
▸ HSP90AA1 P07900 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ LMNA P02545 1/20 0.34
▸ POLB P06746 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL9001911 0.74 RECQL (0.43) RECQLHSP90AA1HSD17B10MAPTALDH1A1
SCHEMBL9002171 0.71 MAPT (0.41) RECQLHSD17B10MAPTALDH1A1LMNA
SCHEMBL9002528 0.69 ALDH1A1 (0.41) RECQLHSD17B10MAPTALDH1A1LMNA
SCHEMBL9001984 0.67 MAPK1 (0.46) RECQLHSD17B10MAPTALDH1A1
SCHEMBL9001904 0.67 MAPT (0.39) RECQLHSD17B10MAPTALDH1A1LMNA
SCHEMBL9002172 0.66 MAPT (0.43) RECQLHSD17B10MAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL9001908 0.66 MAPT (0.42) RECQLHSD17B10MAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL9001897 0.65 HSD17B10 (0.37) RECQLHSD17B10MAPTALDH1A1LMNA
SCHEMBL9002068 0.64 HSD17B10 (0.34) RECQLHSD17B10MAPTALDH1A1LMNA
SCHEMBL9002353 0.63 RAB9A (0.40) RECQLHSD17B10MAPTALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5587383-A CALMODULIN INHIBITORS; ANTIISCHEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-24 — — US disclosed
EP-0471236-B1 Imidazopyridine derivatives and their use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-03-15 — — EP disclosed
US-5395839-A Calmodulin and angiogenesis inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-03-07 — — US disclosed
US-5244908-A Calmodulin inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-09-14 — — US disclosed
EP-0471236-A1 Imidazopyridine derivatives and their use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-02-19 — — EP disclosed
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