SCHEMBL9635101

SCHEMBL9635101

O=S(=O)(c1cccc2cnccc12)N(CCNC/C=C/c1ccc(Cl)cc1)Cc1cccnc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 13/20 0.62
PRKACA P17612 5/20 0.53
ROCK2 O75116 4/20 0.53
AKT2 P31751 4/20 0.53
MAPK1 P28482 3/20 0.53
AKT3 Q9Y243 3/20 0.53
PRKACG P22612 3/20 0.53
PRKACB P22694 3/20 0.53
PRKCG P05129 2/20 0.53
RPS6KB1 P23443 2/20 0.53
AKT1 P31749 2/20 0.53
PRKCZ Q05513 2/20 0.53
PRKCD Q05655 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
CHEK1 O14757 1/20 0.53
AURKA O14965 1/20 0.53
DAPK3 O43293 1/20 0.53
CHEK2 O96017 1/20 0.53
CDK1 P06493 1/20 0.53
MARK3 P27448 1/20 0.53

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
SCHEMBL9635104 1.00 FLT3 (0.62) FLT3PRKACAROCK2AKT2MAPK1
Hydrochloric Acid SCHEMBL9483085 0.99 FLT3 (0.62) FLT3PRKACAROCK2AKT2MAPK1
SCHEMBL9483651 0.94 FLT3 (0.59) FLT3PRKACAROCK2AKT2MAPK1
SCHEMBL9483657 0.94 FLT3 (0.59) FLT3PRKACAROCK2AKT2MAPK1
SCHEMBL9484853 0.88 FLT3 (0.58) FLT3PRKACAROCK2AKT2MAPK1
SCHEMBL9484851 0.88 FLT3 (0.58) FLT3PRKACAROCK2AKT2MAPK1
SCHEMBL2456459 0.88 FLT3 (0.56) FLT3PRKACAROCK2AKT2MAPK1
SCHEMBL2456469 0.88 FLT3 (0.56) FLT3PRKACAROCK2AKT2MAPK1
SCHEMBL9484329 0.87 FLT3 (0.63) FLT3PRKACAROCK2AKT2MAPK1
SCHEMBL9484331 0.87 FLT3 (0.63) FLT3PRKACAROCK2AKT2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5081246-A Isoquinolino sulfonamino derivatives Hidaka, Hiroyoshi (JP) 1992-01-14 US disclosed