SCHEMBL5202622

SCHEMBL5202622

NCC(N)CCCc1cc[nH]n1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.35
SLC6A4 P31645 1/20 0.35

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
Hydrochloric Acid SCHEMBL5201385 0.98 MPO (0.34) MPOSLC6A4
SCHEMBL16869672 0.78 HIF1A (0.37)
SCHEMBL1187446 0.77
SCHEMBL26129787 0.77
SCHEMBL16763155 0.75 KCNH2 (0.35)
SCHEMBL5815984 0.74 HRH1 (0.47)
SCHEMBL3518997 0.74
SCHEMBL27260243 0.74
Betazole SCHEMBL157155 0.73
SCHEMBL29317119 0.71 NOS3 (0.40)

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
WO-2017096063-A1 METHOD FOR TREATING HAIR NOXELL CORPORATION (US) 2017-06-08 WO disclosed
EP-1817379-A2 PYRAZOLE AZOMETHINES AND COLORANTS CONTAINING THESE COMPOUNDS The Procter and Gamble Company (US) 2007-08-15 EP disclosed
WO-2006060564-A2 PYRAZOLE AZOMETHINES AND COLORANTS CONTAINING THESE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2006-06-08 WO disclosed