SCHEMBL10695250

SCHEMBL10695250

CC(C)(CN)c1ccc2[nH]c(-c3c[nH]cn3)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 3/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.34
▸ CBFB Q13951 4/20 0.33
▸ METAP1 P53582 3/20 0.33
▸ NPBWR1 P48145 2/20 0.32
▸ ADORA3 P0DMS8 2/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ LMNA P02545 2/20 0.32
▸ PKM P14618 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TRPV1 Q8NER1 1/20 0.31
▸ P2RY6 Q15077 1/20 0.31
▸ TNKS O95271 1/20 0.31
▸ PARP1 P09874 1/20 0.31
▸ TNKS2 Q9H2K2 1/20 0.31
▸ HPGD P15428 1/20 0.31

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
SCHEMBL10695258 0.90 METAP2 (0.48) METAP2CBFBMETAP1NPBWR1NPC1
SCHEMBL10575751 0.82 METAP2 (0.34) METAP2HDAC6
SCHEMBL10575162 0.81 MTNR1A (0.37) METAP2HDAC6NPC1RAB9ASMN1; SMN2
SCHEMBL10580068 0.81 METAP2 (0.60) METAP2CBFBMETAP1NPC1LMNA
SCHEMBL10576078 0.77 HDAC6 (0.52) HDAC6NPBWR1NPC1LMNARAB9A
SCHEMBL31154200 0.76 GAA (0.48) METAP2NPC1LMNAPKMRAB9A
SCHEMBL10577465 0.76 NPBWR1 (0.53) HDAC6NPBWR1NPC1PKMRAB9A
SCHEMBL10573939 0.76 KDM4E (0.49) HDAC6NPBWR1NPC1RAB9ASMN1; SMN2
SCHEMBL10575172 0.76 PDE2A (0.35) METAP2HDAC6NPC1LMNARAB9A
SCHEMBL10579325 0.75 DGAT1 (0.51) HDAC6NPBWR1SMN1; SMN2TRPV1TNKS

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-0266558-A2 5-Alkylbenzimidazoles, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1988-05-11 — — EP disclosed
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