SCHEMBL11008003

SCHEMBL11008003

Nc1nc2ccc(C(=NO)c3ccccc3)cc2n1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PI4KB Q9UBF8 1/20 0.60
▸ MAPK14 Q16539 2/20 0.42
▸ HCAR1 Q9BXC0 1/20 0.40
▸ KMT2A Q03164 5/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ ALDH1A1 P00352 4/20 0.37
▸ GFER P55789 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.36
▸ ACSS2 Q9NR19 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ FGFR1 P11362 2/20 0.35
▸ CRHBP P24387 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ABL1 P00519 2/20 0.34

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
SCHEMBL11007999 1.00 PI4KB (0.60) PI4KBMAPK14HCAR1KMT2AMEN1
SCHEMBL11015999 0.82 PI4KB (0.69) PI4KBMAPK14KMT2AMEN1SMN1; SMN2
SCHEMBL11016000 0.82 PI4KB (0.69) PI4KBMAPK14KMT2AMEN1SMN1; SMN2
SCHEMBL11010165 0.81 ABL1 (0.50) PI4KBMAPK14HCAR1KMT2AMEN1
SCHEMBL11557178 0.81 PI4KB (0.51) PI4KBMAPK14KMT2AMEN1SMN1; SMN2
SCHEMBL11557174 0.81 PI4KB (0.51) PI4KBMAPK14KMT2AMEN1SMN1; SMN2
SCHEMBL11006351 0.78 PI4KB (0.53) PI4KBHCAR1ALDH1A1GFERACSS2
SCHEMBL11006353 0.78 PI4KB (0.53) PI4KBHCAR1ALDH1A1GFERACSS2
SCHEMBL11011359 0.75 PDE4A (0.44) PI4KBMAPK14HCAR1KMT2AMEN1
SCHEMBL11011358 0.75 PDE4A (0.44) PI4KBMAPK14HCAR1KMT2AMEN1

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-4492708-A Antiviral benzimidazoles ELI LILLY AND COMPANY (US) 1985-01-08 — — US claimed
EP-0111993-A2 Improvements in or relating to benzimidazoles ELI LILLY AND COMPANY (US) 1984-06-27 — — EP claimed
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