SCHEMBL7429272

SCHEMBL7429272

N=C(N)NCC(NS(=O)(=O)c1cccc2cnccc12)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.52
MELK Q14680 2/20 0.49
MAPK1 P28482 1/20 0.49
CAMKK2 Q96RR4 1/20 0.49
PRKD3 O94806 3/20 0.49
PRKCG P05129 3/20 0.49
PRKCB P05771 3/20 0.49
PRKCA P17252 3/20 0.49
PRKCH P24723 3/20 0.49
PRKCI P41743 3/20 0.49
PRKCE Q02156 3/20 0.49
PRKCQ Q04759 3/20 0.49
PRKCZ Q05513 3/20 0.49
PRKCD Q05655 3/20 0.49
PRKD1 Q15139 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2D6 P10635 2/20 0.49
NFKB1 P19838 2/20 0.49

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
SCHEMBL7430584 0.90 PRKCG (0.50) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL2906302 0.85 PRKD3 (0.54) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL7429623 0.84 PRKD3 (0.56) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL7423209 0.84 PRKD3 (0.52) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL7428005 0.84 MELK (0.48) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL10988492 0.84 PRKD3 (0.59) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL7432658 0.82 PRKD3 (0.50) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL7428311 0.82 PRKD3 (0.50) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL7432775 0.82 PRKCG (0.56) KCNA5MELKMAPK1CAMKK2PRKD3
SCHEMBL7433126 0.81 PRKCG (0.59) KCNA5MELKMAPK1CAMKK2PRKD3

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