SCHEMBL6235984

SCHEMBL6235984

CNCCCCCCNc1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 8/20 0.47
F2 P00734 2/20 0.47
PRSS2 P07478 2/20 0.47
PRSS3 P35030 2/20 0.47
TMPRSS6 Q8IU80 2/20 0.47
ST14 Q9Y5Y6 2/20 0.47
APP P05067 1/20 0.43
SIGMAR1 Q99720 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
EPHX1 P07099 1/20 0.38
NQO2 P16083 1/20 0.37

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
SCHEMBL14672058 0.94 MAPT (0.46) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL12736182 0.89 PRSS1 (0.55) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL18549015 0.89 PRSS1 (0.55) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL12712067 0.89 PRSS1 (0.55) PRSS1F2PRSS2PRSS3TMPRSS6
Hydrochloric Acid SCHEMBL4951449 0.87 PRSS1 (0.57) PRSS1F2PRSS2PRSS3TMPRSS6
Hydrochloric Acid SCHEMBL4953031 0.87 PRSS1 (0.57) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL34107 0.87 PRSS1 (0.54) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL13495577 0.85 MAPT (0.50) PRSS1APPMAPTALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL4956812 0.85 PRSS1 (0.55) PRSS1F2PRSS2PRSS3TMPRSS6
Hydrochloric Acid SCHEMBL11700281 0.85 PRSS1 (0.55) PRSS1F2PRSS2PRSS3TMPRSS6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1535899-A1 Dyeing composition comprising at least one tertiary particular p-phenylenediamine, colouring method using same L'OREAL (FR) 2005-06-01 EP disclosed