SCHEMBL2641810

SCHEMBL2641810

CN(C(=O)O)c1ccc(/C=C/c2cccnc2Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SNCA P37840 5/20 0.48
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
NFE2L2 Q16236 7/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
APP P05067 1/20 0.38
NQO2 P16083 1/20 0.38
RELA Q04206 1/20 0.37

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
SCHEMBL2641953 0.85 SNCA (0.46) SNCANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL2641852 0.84 SNCA (0.46) SNCANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL2641877 0.84 SNCA (0.48) SNCANPC1RAB9ALMNASMN1; SMN2
SCHEMBL2641847 0.83 SNCA (0.54) SNCANPC1RAB9ANFE2L2SMN1; SMN2
SCHEMBL2641843 0.83 SNCA (0.54) SNCANPC1RAB9ANFE2L2SMN1; SMN2
SCHEMBL12186029 0.83 SNCA (0.43) SNCANPC1RAB9ANFE2L2LMNA
SCHEMBL2641940 0.80 SNCA (0.42) SNCALMNASMN1; SMN2ALDH1A1CYP1A2
SCHEMBL32661415 0.76 NFE2L2 (0.51) NPC1RAB9ANFE2L2
SCHEMBL2641910 0.76 MAPT (0.41) SNCANPC1RAB9ANFE2L2SMN1; SMN2
SCHEMBL2641905 0.75 NAPRT (0.40) NFE2L2LMNASMN1; SMN2ALDH1A1APP

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