SCHEMBL4405641

SCHEMBL4405641

CCCCCCn1nnc(C(Cl)(Cl)C(Cl)(Cl)Cl)n1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.39
S1PR2 O95136 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
KMT2A Q03164 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
SCHEMBL4409004 0.98 TRPV1 (0.36) TRPV1S1PR2S1PR1S1PR3LPAR2
SCHEMBL4407456 0.93 MAPK1 (0.36) TRPV1KMT2A
SCHEMBL4415113 0.87 TRPV1 (0.40) TRPV1KMT2A
SCHEMBL4405894 0.86 RECQL (0.37) KMT2A
SCHEMBL4408451 0.85 TRPV1 (0.38) TRPV1KMT2A
SCHEMBL4404929 0.80 TRPV1 (0.40) TRPV1KMT2A
SCHEMBL4405805 0.80 TRPV1 (0.39) TRPV1S1PR2S1PR1S1PR3LPAR2
SCHEMBL4407841 0.80 MAPK1 (0.38) KMT2A
SCHEMBL4411350 0.79 LMNA (0.37)
SCHEMBL4405766 0.78 TRPV1 (0.38) 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