SCHEMBL9541258

SCHEMBL9541258

CN(CCN(C)S(=O)(=O)c1cccc2cnccc12)S(=O)(=O)c1cccc2cnccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.62
ROCK2 O75116 5/20 0.58
ROCK1 Q13464 5/20 0.58
P2RX7 Q99572 1/20 0.54
PRKD3 O94806 6/20 0.54
PRKCG P05129 6/20 0.54
PRKCB P05771 6/20 0.54
PRKCA P17252 6/20 0.54
PRKCH P24723 6/20 0.54
PRKCI P41743 6/20 0.54
PRKCE Q02156 6/20 0.54
PRKCQ Q04759 6/20 0.54
PRKCZ Q05513 6/20 0.54
PRKCD Q05655 6/20 0.54
PRKD1 Q15139 6/20 0.54
CYP3A4 P08684 4/20 0.54
CYP2D6 P10635 3/20 0.54
NFKB1 P19838 3/20 0.54
GLA P06280 1/20 0.54
LMNA P02545 2/20 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
SCHEMBL7319386 0.92 FLT3 (0.56) FLT3ROCK2ROCK1P2RX7PRKD3
SCHEMBL10496395 0.92 FLT3 (0.55) FLT3ROCK2ROCK1P2RX7PRKD3
SCHEMBL4729399 0.92 PRKD3 (0.57) FLT3ROCK2ROCK1P2RX7PRKD3
SCHEMBL4727549 0.90 PRKD3 (0.64) FLT3ROCK2ROCK1P2RX7PRKD3
SCHEMBL9542795 0.87 PRKCG (0.68) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL30539980 0.86 ROCK2 (0.62) FLT3ROCK2ROCK1P2RX7PRKD3
SCHEMBL9016177 0.86 ROCK2 (0.62) FLT3ROCK2ROCK1P2RX7PRKD3
SCHEMBL9541277 0.84 PRKCG (0.64) FLT3ROCK2ROCK1P2RX7PRKD3
Hydrochloric Acid SCHEMBL9542896 0.83 LMNA (0.65) FLT3ROCK2ROCK1P2RX7PRKD3
SCHEMBL10979885 0.82 ROCK2 (0.55) FLT3ROCK2ROCK1P2RX7PRKD3

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
WO-1993013072-A1 5-ISOQUINOLINESULFONAMIDE DERIVATIVES AS PROTEIN KINASE INHIBITING AGENTS ITALFARMACO S.P.A. (IT) 1993-07-08 WO disclosed