SCHEMBL9484815

SCHEMBL9484815

C/C=C/c1ccccc1Nc1ccc(NS(=O)(=O)c2cccc3cnccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ 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
▸ CYP3A4 P08684 2/20 0.46
▸ CYP2D6 P10635 2/20 0.46
▸ NFKB1 P19838 2/20 0.46
▸ GLA P06280 1/20 0.46
▸ KCNA5 P22460 1/20 0.45
▸ LMNA P02545 2/20 0.45
▸ PMP22 Q01453 1/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44

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
SCHEMBL17737761 0.78 PRKD3 (0.59) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL17737439 0.77 MEN1 (0.54) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL17737346 0.75 MEN1 (0.60) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL17737682 0.74 MEN1 (0.56) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL11882678 0.70 HTT (0.54) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL9484358 0.70 CYP17A1 (0.68) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL17737794 0.69 SLC40A1 (0.61) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL10978592 0.69 PRKCG (0.70) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL9484806 0.68 PRKACA (0.56) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL1760052 0.68 — —

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
US-5245034-A Compound having vessel smooth muscle relaxation activity Hidaka, Kiroyoshi (JP) 1993-09-14 — — US disclosed
US-5216150-A Muscle relaxant; enzyme inhibitor and platelet aggutination inhibitor Hidaka, Hiroyoshi (JP) 1993-06-01 — — US disclosed
US-5081246-A Isoquinolino sulfonamino derivatives Hidaka, Hiroyoshi (JP) 1992-01-14 — — US disclosed
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