SCHEMBL2641857

SCHEMBL2641857

CNc1ccc(/C=C/c2ccnc(F)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.50
APP P05067 18/20 0.49
MAT2A P31153 1/20 0.44
MAPT P10636 1/20 0.42
SNCA P37840 1/20 0.42

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
SCHEMBL2641860 1.00 KCNH2 (0.50) KCNH2APPMAT2AMAPTSNCA
SCHEMBL7970830 0.82 LOXL2 (0.45) MAPT
SCHEMBL7970832 0.82 LOXL2 (0.45) MAPT
SCHEMBL2879571 0.80 NFE2L2 (0.52) APP
SCHEMBL2879570 0.80 NFE2L2 (0.52) APP
SCHEMBL12185927 0.77 KDM1A (0.55) APPMAPT
SCHEMBL12185880 0.77 NQO2 (0.50) APPMAPT
SCHEMBL2641826 0.77 CYP1A2 (0.61) MAPT
SCHEMBL12186016 0.77 MAPT (0.61) KCNH2APPMAT2AMAPT
SCHEMBL2641818 0.77 CYP1A2 (0.61) MAPT

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
WO-2011141515-A1 DIAGNOSTIC AGENTS FOR AMYLOID BETA IMAGING BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-11-17 WO disclosed
WO-2011141515-A1 DIAGNOSTIC AGENTS FOR AMYLOID BETA IMAGING BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-11-17 WO disclosed