SCHEMBL10982199

SCHEMBL10982199

CC(C)C1CN(S(=O)(=O)c2cccc3cnccc23)CCN1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 5/20 0.77
PRKCG P05129 5/20 0.77
PRKCB P05771 5/20 0.77
PRKCA P17252 5/20 0.77
PRKCH P24723 5/20 0.77
PRKCI P41743 5/20 0.77
PRKCE Q02156 5/20 0.77
PRKCQ Q04759 5/20 0.77
PRKCZ Q05513 5/20 0.77
PRKCD Q05655 5/20 0.77
PRKD1 Q15139 5/20 0.77
CYP3A4 P08684 4/20 0.77
CYP2D6 P10635 3/20 0.77
NFKB1 P19838 2/20 0.77
PRKACA P17612 4/20 0.65
PRKACG P22612 4/20 0.65
PRKACB P22694 4/20 0.65
ADORA3 P0DMS8 2/20 0.65
CYP2C19 P33261 2/20 0.65
KDM4E B2RXH2 1/20 0.65

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
SCHEMBL30084457 0.87 PRKD3 (1.00) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL1165362 0.87 PRKD3 (1.00) PRKD3PRKCGPRKCBPRKCAPRKCH
Hydrochloric Acid SCHEMBL20553518 0.86 PRKD3 (0.98) PRKD3PRKCGPRKCBPRKCAPRKCH
Hydrochloric Acid SCHEMBL1321843 0.86 PRKD3 (0.98) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL2906235 0.85 PRKD3 (0.72) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL10988093 0.83 PRKD3 (0.77) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL10990524 0.81 PRKD3 (0.73) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL18599911 0.81 PRKD3 (0.87) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL2457955 0.81 PRKD3 (0.87) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL9363729 0.80 PRKD3 (0.71) PRKD3PRKCGPRKCBPRKCAPRKCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4560755-A VASODILATOR, HYPOTENSOR ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-12-24 US disclosed
US-4525589-A Isoquinolinesulfonyl derivatives ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-06-25 US disclosed
EP-0061673-B1 ISOQUINOLINESULFONYL DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-10-24 EP disclosed
US-4456757-A MUSCLE RELAXANTS, VASODILATORS, HYPOTENSIVE AGENTS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1984-06-26 US disclosed
EP-0061673-A1 Isoquinolinesulfonyl derivatives and process for the preparation thereof Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-10-06 EP disclosed