SCHEMBL7298281

SCHEMBL7298281

CNC(=O)Cc1cccc2nsnc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.47
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
KDM4E B2RXH2 6/20 0.44
HPGD P15428 5/20 0.44
CASP1 P29466 2/20 0.44
HSD17B10 Q99714 2/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
PPARG P37231 1/20 0.44
HTT P42858 1/20 0.44
NCOA2 Q15596 1/20 0.44
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
TSHR P16473 1/20 0.44
CASP7 P55210 1/20 0.44
GAA P10253 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL25400526 0.82 SMN1; SMN2 (0.46) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL7299402 0.81 KDM4E (0.56) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL13940123 0.79 ALDH1A1 (0.49) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL762893 0.77 KMT2A (0.56) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL17040325 0.77 ATM (0.47) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL25399680 0.75 SMN1; SMN2 (0.45) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL25406586 0.75 TSHR (0.43) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL25409819 0.74 ALDH1A1 (0.41) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL17037432 0.73 ATM (0.47) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD
SCHEMBL7718402 0.73 KDM4E (0.52) ALDH1A1MAPTSMN1; SMN2KDM4EHPGD

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
EP-0304789-A2 Benzimidazole derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1989-03-01 EP disclosed