SCHEMBL6489664

SCHEMBL6489664

[CH2]C1(C(C)C)N=c2ccccc2=N1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
HCRTR1 O43613 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL3974680 0.76
SCHEMBL3972365 0.72 KDM4E (0.34) KDM4EHCRTR1LMNAMAPT
SCHEMBL3967439 0.71 KDM4E (0.32) KDM4EHCRTR1LMNAMAPT
SCHEMBL3973617 0.67 KDM4E (0.31) KDM4EHCRTR1LMNAMAPT
SCHEMBL3970831 0.67 KDM4E (0.33) KDM4EHCRTR1LMNAMAPT
SCHEMBL3968505 0.67 KDM4E (0.32) KDM4EHCRTR1LMNAMAPT
SCHEMBL3971845 0.67 KDM4E (0.32) KDM4EHCRTR1LMNAMAPT
SCHEMBL3962249 0.67 KDM4E (0.32) KDM4EHCRTR1LMNAMAPT
SCHEMBL10446780 0.66 KDM4E (0.36) KDM4EHCRTR1LMNAMAPT
SCHEMBL3974069 0.64 KDM4E (0.32) KDM4EHCRTR1LMNAMAPT

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-6884806-B2 Bicyclic lactam derivatives as inhibitors of matrix metalloproteinases and/or TNF-α converting enzyme (TACE) BRISTOL-MYERS SQUIBB COMPANY (US) 2005-04-26 US disclosed