SCHEMBL7326368

SCHEMBL7326368

CCCCCCNCCCCCCN(CCCCCC)S(=O)(=O)c1cccc2cnccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 5/20 0.53
ROCK2 O75116 3/20 0.52
ROCK1 Q13464 3/20 0.52
PRKD3 O94806 3/20 0.48
PRKCG P05129 3/20 0.48
PRKCB P05771 3/20 0.48
PRKCA P17252 3/20 0.48
PRKCH P24723 3/20 0.48
PRKCI P41743 3/20 0.48
PRKCE Q02156 3/20 0.48
PRKCQ Q04759 3/20 0.48
PRKCZ Q05513 3/20 0.48
PRKCD Q05655 3/20 0.48
PRKD1 Q15139 3/20 0.48
PRKACA P17612 2/20 0.48
PRKACG P22612 2/20 0.48
PRKACB P22694 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
NFKB1 P19838 2/20 0.48

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
SCHEMBL7319184 0.99 FLT3 (0.52) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7321262 0.98 FLT3 (0.54) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7319826 0.96 FLT3 (0.54) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7316386 0.94 ROCK2 (0.51) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7318253 0.92 FLT3 (0.54) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7327049 0.91 FLT3 (0.48) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7323341 0.89 ROCK2 (0.54) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7326654 0.89 ROCK2 (0.54) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7326840 0.89 ROCK2 (0.54) FLT3ROCK2ROCK1PRKD3PRKCG
SCHEMBL7319000 0.89 ROCK2 (0.54) FLT3ROCK2ROCK1PRKD3PRKCG

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-0287696-B1 ISOQUINOLINE DERIVATIVES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1991-01-02 EP disclosed
US-4798897-A (AMINOALKYL)AMINOSULFONYL-SUBSTITUTED CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1989-01-17 US disclosed
EP-0287696-A1 Isoquinoline derivatives Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1988-10-26 EP disclosed