SCHEMBL11734656

SCHEMBL11734656

Cn1ccnc1Sc1ccc(N)c(N)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCK P35557 9/20 0.52
KMT2A Q03164 3/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 3/20 0.39
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL5654722 0.81 GCK (0.46) GCKKMT2ALMNAALDH1A1MEN1
SCHEMBL11730615 0.81 LMNA (0.59) GCKKMT2ALMNAALDH1A1MEN1
SCHEMBL2668152 0.76 GCK (0.44) GCKKMT2ALMNAALDH1A1
SCHEMBL10395347 0.75 GCK (0.45) GCKKMT2ALMNAALDH1A1CHRM5
SCHEMBL191452 0.74 GCK (0.47) GCKKMT2ALMNAALDH1A1CHRM5
SCHEMBL3531433 0.74 GCK (0.52) GCKKMT2ALMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL10395339 0.74 LMNA (0.46) GCKKMT2ALMNAALDH1A1CHRM5
SCHEMBL10395769 0.74 KMT2A (0.62) GCKKMT2ALMNAALDH1A1NPC1
SCHEMBL5654395 0.72 ALDH1A1 (0.59) GCKKMT2ALMNAALDH1A1MEN1
SCHEMBL4251207 0.71 GCK (0.44) GCKKMT2ALMNAALDH1A1NPC1

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
US-4005202-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1977-01-25 US disclosed
US-3935209-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-01-27 US disclosed