SCHEMBL7426552

SCHEMBL7426552

CCCCC(CNC(=N)N)NS(=O)(=O)c1cccc2cnccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
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
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
NFKB1 P19838 2/20 0.48
GLA P06280 1/20 0.48
LMNA P02545 3/20 0.47
PMP22 Q01453 1/20 0.47
MELK Q14680 2/20 0.47
MAPK1 P28482 1/20 0.47
CAMKK2 Q96RR4 1/20 0.47

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
SCHEMBL10754020 0.94 MELK (0.48) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL7428311 0.90 PRKD3 (0.50) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL7433504 0.86 PRKD3 (0.55) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL10983757 0.85 PRKD3 (0.56) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL7423209 0.84 PRKD3 (0.52) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL7428005 0.83 MELK (0.48) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL2911120 0.83 MEN1 (0.33) CYP3A4MEN1KMT2ATP53F2
SCHEMBL7432658 0.82 PRKD3 (0.50) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL8672488 0.82 MEN1 (0.37) CYP3A4MEN1KMT2ATP53F2
SCHEMBL10746923 0.82 MELK (0.48) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4709032-A VASODILATION AND HYPOTENSIVE AGENT ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1987-11-24 US disclosed
US-4634770-A VASODILATORS, HYPOTENSIVES ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1987-01-06 US disclosed
EP-0109023-A1 Isoquinolinesulfonamide derivatives and process for the preparation thereof Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-05-23 EP disclosed