SCHEMBL6276281

SCHEMBL6276281

COC(=O)N=Nc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.56
RAB9A P51151 5/20 0.56
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CES2 O00748 3/20 0.54
ACHE P22303 3/20 0.54
CES1 P23141 3/20 0.54
F2 P00734 1/20 0.52
SMN1; SMN2 Q16637 5/20 0.47
NPC1 O15118 3/20 0.47
TRPA1 O75762 1/20 0.45
ALDH1A1 P00352 5/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPK1 P28482 3/20 0.44
ATM Q13315 1/20 0.44
KCNN4 O15554 1/20 0.44

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
SCHEMBL10828102 1.00 MAPT (0.56) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL17182759 0.79 CES2 (0.57) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL17182758 0.79 CES2 (0.57) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL17182764 0.79 TSHR (0.44) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL17182763 0.79 TSHR (0.44) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL282530 0.78 MAPT (0.50) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL10376096 0.76 MAPT (0.52) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL27680737 0.75 MAPT (0.50) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL592051 0.75 F2 (0.55) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL592052 0.75 F2 (0.55) MAPTRAB9ACASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005106025-A1 METABOLIC TEST PML APPLICATIONS LTD. (GB) 2005-11-10 WO disclosed
EP-0138750-B1 PROCESS FOR THE PRODUCTION OF SUBSTITUTED BENZIMIDAZOLES CIBA-GEIGY AG (CH) 1987-09-09 EP disclosed
EP-0138760-B1 PROCESS FOR THE PREPARATION OF N-SUBSTITUTED ORTHO-PHENYLENE-DIAMINES CIBA-GEIGY AG (CH) 1986-12-10 EP disclosed
EP-0138760-A1 Process for the preparation of N-substituted ortho-phenylene-diamines CIBA-GEIGY AG (CH) 1985-04-24 EP disclosed
EP-0138750-A1 Process for the production of substituted benzimidazoles CIBA-GEIGY AG (CH) 1985-04-24 EP disclosed