SCHEMBL6068464

SCHEMBL6068464

CN(CC(=O)O)c1c(N)cnn1CCC(N)=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMO O15229 5/20 0.35
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
PTGIR P43119 2/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL6068659 0.84 ADORA2A (0.32) KMO
SCHEMBL6068838 0.84 MEN1 (0.34) KMOMAPK1MEN1KMT2ASMN1; SMN2
SCHEMBL6068794 0.82 KCNH2 (0.33) KMOPTGIR
SCHEMBL6068826 0.81
SCHEMBL6068765 0.79 PTGIR (0.31) PTGIR
SCHEMBL6068842 0.78 PDE4A (0.33) KMOMAPK1MEN1KMT2ASMN1; SMN2
SCHEMBL5425093 0.78 SMPD3 (0.30) KMT2A
SCHEMBL6068784 0.75 PTGIR (0.38) PTGIR
SCHEMBL6068515 0.75 MAPK1 (0.33) MAPK1OPRM1OPRL1LMNA
SCHEMBL6068670 0.74 MEN1 (0.33) KMOMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091350-B2 Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres L'OREAL (FR) 2006-08-15 US disclosed