SCHEMBL6068547

SCHEMBL6068547

NCCN(CCN)c1c(N)cnn1CC(N)=O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPK1 P28482 1/20 0.30
TSHR P16473 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
SCHEMBL6068718 0.88 KMO (0.36) LMNAKDM4E
SCHEMBL6068655 0.88 ABL1 (0.31) LMNAKDM4EMAPK1TSHR
SCHEMBL6068670 0.85 MEN1 (0.33) KDM4E
SCHEMBL6068949 0.83 LMNA (0.34) LMNAKDM4EMAPK1TSHR
SCHEMBL6068684 0.79 LMNA (0.36) LMNAKDM4EMAPK1TSHR
SCHEMBL6068975 0.76 MEN1 (0.31)
SCHEMBL6068685 0.75 KMO (0.36) LMNAKDM4E
SCHEMBL6068611 0.75 LMNA (0.32) LMNA
SCHEMBL1803436 0.74 TSHR (0.38) LMNAKDM4EMAPK1TSHR
SCHEMBL6068734 0.73 KMO (0.31) KDM4E

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