SCHEMBL6234558

SCHEMBL6234558

O=S(=O)(NC1CCCNC1)c1cccc2cnccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 11/20 0.63
PRKD3 O94806 6/20 0.52
PRKCG P05129 6/20 0.52
PRKCB P05771 6/20 0.52
PRKCA P17252 6/20 0.52
PRKCH P24723 6/20 0.52
PRKCI P41743 6/20 0.52
PRKCE Q02156 6/20 0.52
PRKCQ Q04759 6/20 0.52
PRKCD Q05655 6/20 0.52
PRKD1 Q15139 6/20 0.52
PRKACA P17612 5/20 0.52
PRKACG P22612 5/20 0.52
PRKACB P22694 5/20 0.52
CYP3A4 P08684 5/20 0.52
PRKD2 Q9BZL6 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
MEN1 O00255 4/20 0.52
CYP2D6 P10635 4/20 0.52
KMT2A Q03164 4/20 0.52

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
SCHEMBL6238571 0.86 PRKCZ (0.57) PRKCZPRKD3PRKCGPRKCBPRKCA
SCHEMBL9541300 0.84 PRKCZ (0.53) PRKCZPRKD3PRKCGPRKCBPRKCA
SCHEMBL5662642 0.80 PRKD3 (0.51) PRKCZPRKD3PRKCGPRKCBPRKCA
SCHEMBL9543831 0.79 PRKD3 (0.55) PRKCZPRKD3PRKCGPRKCBPRKCA
SCHEMBL528390 0.77 PRKCZ (1.00) PRKCZPRKD2ROCK2ROCK1
SCHEMBL661175 0.77 PRKCZ (1.00) PRKCZPRKD2ROCK2ROCK1
SCHEMBL660022 0.77 PRKCZ (1.00) PRKCZPRKD2ROCK2ROCK1
Hydrochloric Acid SCHEMBL5662171 0.76 PRKCZ (0.97) PRKCZPRKD2ROCK2ROCK1
SCHEMBL13188191 0.76 PRKCZ (0.45) PRKCZSMN1; SMN2ROCK2ROCK1HTR1A
SCHEMBL17228283 0.76 ROCK2 (0.64) PRKCZPRKD3PRKCGPRKCBPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005011697-A2 SULFONAMIDE DERIVATIVES WITH ACTIVITY ON PROTEIN KINASE A AND B ASTEX THERAPEUTICS LIMITED (GB) 2005-02-10 WO claimed
WO-2005011697-A2 SULFONAMIDE DERIVATIVES WITH ACTIVITY ON PROTEIN KINASE A AND B ASTEX THERAPEUTICS LIMITED (GB) 2005-02-10 WO disclosed
EP-0287696-B1 ISOQUINOLINE DERIVATIVES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1991-01-02 EP disclosed
EP-0287696-A1 Isoquinoline derivatives Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1988-10-26 EP disclosed