SCHEMBL4409043

SCHEMBL4409043

CCCCc1nnn(CCCC)n1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
TSHR P16473 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
SCHEMBL4407275 0.94 TRPV1 (0.40) KMT2AMEN1
SCHEMBL4405663 0.94 KMT2A (0.40) KMT2AMEN1
SCHEMBL4405868 0.92 TRPV1 (0.42) KMT2A
SCHEMBL4405063 0.92 TRPV1 (0.39) KMT2A
SCHEMBL4414593 0.92 KMT2A (0.38) KMT2AMEN1RAB9ANPC1TSHR
SCHEMBL4412152 0.92 KMT2A (0.45) KMT2AMEN1
SCHEMBL4403847 0.90 TRPV1 (0.40) KMT2A
SCHEMBL4412199 0.89 TRPV1 (0.42) KMT2A
SCHEMBL4405965 0.89 TRPV1 (0.42) KMT2A
SCHEMBL4412043 0.89 TRPV1 (0.42) KMT2A

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