SCHEMBL7316260

SCHEMBL7316260

O=S(=O)(c1cccc2cnccc12)N(CCNCc1ccccc1)Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 5/20 0.51
P2RX7 Q99572 4/20 0.46
ROCK1 Q13464 2/20 0.46
ROCK2 O75116 1/20 0.46
PRKD3 O94806 3/20 0.46
PRKCG P05129 3/20 0.46
PRKCB P05771 3/20 0.46
PRKCA P17252 3/20 0.46
PRKCH P24723 3/20 0.46
PRKCI P41743 3/20 0.46
PRKCE Q02156 3/20 0.46
PRKCQ Q04759 3/20 0.46
PRKCZ Q05513 3/20 0.46
PRKCD Q05655 3/20 0.46
PRKD1 Q15139 3/20 0.46
MEN1 O00255 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2D6 P10635 2/20 0.46
NFKB1 P19838 2/20 0.46
KMT2A Q03164 2/20 0.46

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
SCHEMBL9543805 0.87 PRKACA (0.60) FLT3P2RX7ROCK1ROCK2PRKD3
SCHEMBL7315200 0.86 FLT3 (0.48) FLT3P2RX7ROCK1ROCK2PRKD3
SCHEMBL4726325 0.84 MEN1 (0.52) FLT3P2RX7ROCK1ROCK2PRKD3
SCHEMBL7323736 0.84 P2RX7 (0.49) FLT3P2RX7ROCK1ROCK2PRKD3
SCHEMBL7327049 0.82 FLT3 (0.48) FLT3P2RX7ROCK1ROCK2PRKD3
SCHEMBL9483651 0.82 FLT3 (0.59) FLT3P2RX7ROCK1ROCK2PRKD3
SCHEMBL9483657 0.82 FLT3 (0.59) FLT3P2RX7ROCK1ROCK2PRKD3
SCHEMBL4729523 0.79 FLT3 (0.55) FLT3P2RX7ROCK1ROCK2PRKD3
SCHEMBL9544837 0.78 PRKACA (0.60) FLT3ROCK1ROCK2PRKD3PRKCG
SCHEMBL7321763 0.78 PRKCG (0.51) FLT3P2RX7ROCK1ROCK2PRKD3

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