SCHEMBL19502995

SCHEMBL19502995

C=C(/C=C\C=C/C)Nc1ccccc1NC=N

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL21861083 0.79 NPC1 (0.47) ALDH1A1SMN1; SMN2
SCHEMBL21944495 0.73 MAOB (0.42) ALDH1A1SMN1; SMN2
SCHEMBL4547005 0.68 MAPT (0.47) ALDH1A1SMN1; SMN2
SCHEMBL21290371 0.66 NPC1 (0.52) ALDH1A1
SCHEMBL19403909 0.66 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2
SCHEMBL21781161 0.65 TGM2 (0.46) ALDH1A1
SCHEMBL19622137 0.65 KDM4E (0.42) ALDH1A1RECQL
SCHEMBL14314944 0.64 MAOA (0.40) ALDH1A1
SCHEMBL21290344 0.64 NPC1 (0.48) ALDH1A1SMN1; SMN2
SCHEMBL24004141 0.62 GAA (0.51) ALDH1A1

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-3232485-A1 BENZIMIDAZO[1,2-A]BENZIMIDAZOLE DERIVATIVES FOR ELECTRONIC APPLICATIONS UDC Ireland Limited (IE) 2017-10-18 — — EP disclosed
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