SCHEMBL4408230

SCHEMBL4408230

CCCCCCc1nnn(CCC)n1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.43
RECQL P46063 1/20 0.41
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL4411053 0.98 KMT2A (0.46) KMT2AMEN1RECQLALDH1A1LMNA
SCHEMBL4405063 0.93 TRPV1 (0.39) KMT2A
SCHEMBL4412043 0.93 TRPV1 (0.42) KMT2A
SCHEMBL4412199 0.93 TRPV1 (0.42) KMT2A
SCHEMBL4405965 0.93 TRPV1 (0.42) KMT2A
SCHEMBL4412152 0.92 KMT2A (0.45) KMT2AMEN1RECQLALDH1A1LMNA
SCHEMBL4403847 0.91 TRPV1 (0.40) KMT2A
SCHEMBL4405663 0.91 KMT2A (0.40) KMT2AMEN1
SCHEMBL4405868 0.89 TRPV1 (0.42) KMT2A
SCHEMBL4408985 0.87 GPR84 (0.37) LMNA

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