SCHEMBL18934311

SCHEMBL18934311

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc6nc7[nH]c8ccccc8n7c6c54)c3)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MGAM O43451 1/20 0.32
▸ SI P14410 1/20 0.32
▸ MGAM2 Q2M2H8 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.31
▸ ADORA3 P0DMS8 2/20 0.31
▸ ATM Q13315 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
SCHEMBL18934274 0.89 KDM4E (0.34) GAAKDM4ENPC1ALDH1A1LMNA
SCHEMBL18934619 0.88 ALDH1A1 (0.40) GAAKDM4ENPC1ALDH1A1LMNA
SCHEMBL18934711 0.83 KDM4E (0.34) GAAKDM4ENPC1ALDH1A1LMNA
SCHEMBL18934715 0.83 KDM4E (0.34) GAAKDM4ENPC1ALDH1A1LMNA
SCHEMBL19652297 0.82 L3MBTL1 (0.44) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL12690803 0.81 L3MBTL1 (0.47) GAAKDM4EALDH1A1MAPTHSD17B10
SCHEMBL2754641 0.81 L3MBTL1 (0.47) GAAKDM4EALDH1A1MAPTHSD17B10
SCHEMBL20617230 0.81 ADORA2B (0.36) GAAKDM4EALDH1A1MAPTHSD17B10
SCHEMBL12691140 0.80 L3MBTL1 (0.46) GAAKDM4EALDH1A1MAPTHSD17B10
SCHEMBL17809175 0.80 ATM (0.42) GAAKDM4EALDH1A1PKMMEN1

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
WO-2017093958-A1 BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLE DERIVATIVES FOR ORGANIC LIGHT EMITTING DIODES IDEMITSU KOSAN CO., LTD. (JP) 2017-06-08 — — WO disclosed
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