SCHEMBL9483228

SCHEMBL9483228

O=S(=O)(c1cccc2cnccc12)N(CCO)c1ccccc1NCC=Cc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 6/20 0.47
▸ ROCK2 O75116 5/20 0.44
▸ PRKACA P17612 4/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ AKT2 P31751 3/20 0.44
▸ AKT3 Q9Y243 3/20 0.44
▸ ROCK1 Q13464 3/20 0.44
▸ PRKCG P05129 2/20 0.44
▸ RPS6KB1 P23443 2/20 0.44
▸ AKT1 P31749 2/20 0.44
▸ PRKCZ Q05513 2/20 0.44
▸ PRKCD Q05655 2/20 0.44
▸ PRKACG P22612 2/20 0.44
▸ PRKACB P22694 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ CHEK1 O14757 1/20 0.44
▸ AURKA O14965 1/20 0.44
▸ DAPK3 O43293 1/20 0.44
▸ CHEK2 O96017 1/20 0.44

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
SCHEMBL9483224 1.00 FLT3 (0.47) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9484225 0.91 FLT3 (0.51) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9484230 0.91 FLT3 (0.51) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9483550 0.87 FLT3 (0.53) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9483554 0.87 FLT3 (0.53) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9484501 0.80 PRKACA (0.55) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9484505 0.80 PRKACA (0.55) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9635154 0.77 PRKACA (0.56) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9483339 0.77 FLT3 (0.54) FLT3ROCK2PRKACASMN1; SMN2MAPK1
SCHEMBL9483346 0.77 FLT3 (0.54) FLT3ROCK2PRKACASMN1; SMN2MAPK1

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
US-5245034-A Compound having vessel smooth muscle relaxation activity Hidaka, Kiroyoshi (JP) 1993-09-14 — — US disclosed
US-5216150-A Muscle relaxant; enzyme inhibitor and platelet aggutination inhibitor Hidaka, Hiroyoshi (JP) 1993-06-01 — — US disclosed
US-5081246-A Isoquinolino sulfonamino derivatives Hidaka, Hiroyoshi (JP) 1992-01-14 — — US disclosed
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