SCHEMBL4411853

SCHEMBL4411853

CCCCCn1nnc(CC(C)(C)C)n1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 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
SCHEMBL4407397 0.98 TRPV1 (0.39) TRPV1KMT2A
SCHEMBL4405193 0.95 HSD17B10 (0.36) KMT2AMEN1
SCHEMBL4413603 0.87 ALDH1A1 (0.39) KMT2AMEN1
SCHEMBL4411081 0.82 KMT2A (0.41) TRPV1KMT2AMEN1
SCHEMBL4405330 0.80 TRPV1 (0.43) TRPV1KMT2A
SCHEMBL4403847 0.80 TRPV1 (0.40) TRPV1KMT2A
SCHEMBL4405519 0.80 TRPV1 (0.40) TRPV1KMT2AMEN1
SCHEMBL4407275 0.80 TRPV1 (0.40) TRPV1KMT2AMEN1
SCHEMBL4409055 0.80 SMN1; SMN2 (0.42)
SCHEMBL4405965 0.79 TRPV1 (0.42) TRPV1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1859782-B1 Composition for coloring and/or lightening human hair comprising tetrazoles HENKEL AG & CO KGAA (DE) 2009-12-30 EP disclosed
EP-1859782-A1 Composition for coloring and/or lightening human hair comprising tetrazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed