SCHEMBL5045121

SCHEMBL5045121

COc1c(C)ccc(C2=CC[N]CC2)c1C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.31

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
SCHEMBL3537029 0.76 KDM4E (0.37)
SCHEMBL3547593 0.73 ALDH1A1 (0.32) MAOA
SCHEMBL5584244 0.73 KDM4E (0.44)
SCHEMBL3543903 0.68 SLC2A1 (0.40)
SCHEMBL5584724 0.65 CYP19A1 (0.40)
SCHEMBL146614 0.63 ALDH1A1 (0.39)
SCHEMBL30968870 0.63 ALDH1A1 (0.39)
SCHEMBL13019332 0.63 SCN4A (0.36) MAOA
SCHEMBL5035228 0.61 AHR (0.39) MAOA
SCHEMBL30192941 0.60 ALDH1A1 (0.45) MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1622569-A4 AZA SPIRO ALKANE DERIVATIVES AS INHIBITORS OF METALLPROTEASES INCYTE CORP (US) 2008-08-27 EP disclosed
EP-1622569-A2 AZA SPIRO ALKANE DERIVATIVES AS INHIBITORS OF METALLPROTEASES Incyte Corporation (US) 2006-02-08 EP disclosed
WO-2004096139-A2 AZA SPIRO ALKANE DERIVATIVES AS INHIBITORS OF METALLOPROTEASES INCYTE CORPORATION (US) 2004-11-11 WO disclosed