SCHEMBL12465638

SCHEMBL12465638

CC(=O)N1Cc2ccc(C(Br)C=O)cc2C(C)(C)C1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.36

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
SCHEMBL6335311 0.72 NOTUM (0.59) NOTUM
SCHEMBL12465637 0.72 GNG2 (0.38) NOTUM
SCHEMBL3819800 0.69 RXRA (0.49)
SCHEMBL11988475 0.69 NOTUM (0.42) NOTUM
SCHEMBL450030 0.68 HSD17B3 (0.44) NOTUM
SCHEMBL12465677 0.68 MCHR1 (0.32) NOTUM
SCHEMBL12465974 0.67 NOTUM (0.33) NOTUM
SCHEMBL5626609 0.66 NOTUM (0.42) NOTUM
SCHEMBL15388711 0.66 GNG2 (0.38) NOTUM
SCHEMBL20883595 0.65 HSP90AA1 (0.41) NOTUM

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-2670744-A1 PYRROLE DERIVATIVES USED AS MODULATORS OF ALPHA7 NACHR Lupin Limited (IN) 2013-12-11 EP disclosed
WO-2012104782-A1 PYRROLE DERIVATIVES USED AS MODULATORS OF ALPHA7 NACHR LUPIN LIMITED (IN) 2012-08-09 WO disclosed