SCHEMBL7428005

SCHEMBL7428005

N=C(N)NCC(Cc1ccccc1)NS(=O)(=O)c1cccc2cnccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MELK Q14680 2/20 0.48
MAPK1 P28482 1/20 0.48
CAMKK2 Q96RR4 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PRKD3 O94806 2/20 0.47
PRKCG P05129 2/20 0.47
PRKCB P05771 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
PRKCA P17252 2/20 0.47
NFKB1 P19838 2/20 0.47
PRKCH P24723 2/20 0.47
PRKCI P41743 2/20 0.47
PRKCE Q02156 2/20 0.47
PRKCQ Q04759 2/20 0.47
PRKCZ Q05513 2/20 0.47
PRKCD Q05655 2/20 0.47
PRKD1 Q15139 2/20 0.47
TP53 P04637 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
SCHEMBL7429931 0.90 MELK (0.48) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL7428311 0.87 PRKD3 (0.50) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL7430116 0.86 PRKD3 (0.55) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL7427548 0.85 PRKD3 (0.52) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL10754020 0.85 MELK (0.48) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL7429272 0.84 KCNA5 (0.52) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL7426552 0.83 PRKD3 (0.48) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL7423209 0.83 PRKD3 (0.52) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL7432964 0.82 PRKD3 (0.58) MELKMAPK1CAMKK2MEN1KMT2A
SCHEMBL7422710 0.82 PRKD3 (0.53) MELKMAPK1CAMKK2MEN1KMT2A

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