SCHEMBL4408760

SCHEMBL4408760

CCCCc1nnn(CC)n1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PKM P14618 1/20 0.34
ATM Q13315 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HTR1A P08908 1/20 0.34
HTR2C P28335 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM3 P20309 1/20 0.33

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
SCHEMBL4411011 0.94 GPR84 (0.38) LMNASMN1; SMN2PKMATMHSD17B10
SCHEMBL4408985 0.92 GPR84 (0.37) LMNASMN1; SMN2
SCHEMBL4409234 0.87 SMN1; SMN2 (0.40) LMNASMN1; SMN2PKMATMHSD17B10
SCHEMBL4409043 0.86 KMT2A (0.38) MEN1KMT2A
SCHEMBL4412152 0.86 KMT2A (0.45) LMNAMEN1KMT2A
SCHEMBL4407275 0.84 TRPV1 (0.40) MEN1KMT2A
SCHEMBL4405868 0.82 TRPV1 (0.42) KMT2A
SCHEMBL4408481 0.81 PKM (0.31) PKMATMHSD17B10
SCHEMBL4403741 0.81 TRPV1 (0.48) PKMATMHSD17B10
SCHEMBL4411053 0.80 KMT2A (0.46) LMNAMEN1KMT2A

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