SCHEMBL7323690

SCHEMBL7323690

CCCCCCN(CCCCCC)CCN(Cc1ccccc1)S(=O)(=O)c1cccc2cnccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 7/20 0.49
ROCK2 O75116 6/20 0.49
P2RX7 Q99572 1/20 0.44
FLT3 P36888 2/20 0.41
CNR2 P34972 1/20 0.40
PRKD3 O94806 2/20 0.40
PRKCG P05129 2/20 0.40
PRKCB P05771 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
PRKCA P17252 2/20 0.40
NFKB1 P19838 2/20 0.40
PRKCH P24723 2/20 0.40
PRKCI P41743 2/20 0.40
PRKCE Q02156 2/20 0.40
PRKCQ Q04759 2/20 0.40
PRKCZ Q05513 2/20 0.40
PRKCD Q05655 2/20 0.40
PRKD1 Q15139 2/20 0.40
GLA P06280 1/20 0.40

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
SCHEMBL7320231 0.81 ROCK1 (0.53) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL4726325 0.81 MEN1 (0.52) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL7323736 0.81 P2RX7 (0.49) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL7315200 0.81 FLT3 (0.48) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL7327049 0.81 FLT3 (0.48) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL7326840 0.80 ROCK2 (0.54) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL7326654 0.80 ROCK2 (0.54) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL7319000 0.80 ROCK2 (0.54) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL7319670 0.80 ROCK2 (0.54) ROCK1ROCK2P2RX7FLT3PRKD3
SCHEMBL7323341 0.80 ROCK2 (0.54) ROCK1ROCK2P2RX7FLT3PRKD3

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