SCHEMBL11095601

SCHEMBL11095601

O=C(C1=NNc2ccccc2C=C1)n1ccnc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.34
▸ FAAH O00519 2/20 0.34
▸ MGLL Q99685 2/20 0.34
▸ CYP24A1 Q07973 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 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
SCHEMBL1226277 0.74 MAPT (0.42) MAPTGAAALDH1A1LMNA
Benzodiazepine SCHEMBL6424821 0.73 FAAH (0.41) MAPTFAAHMGLLCYP24A1ALDH1A1
SCHEMBL7026732 0.72 MAPT (0.41) MAPTGAALMNA
SCHEMBL4058588 0.72 MAPT (0.41) MAPTGAALMNA
SCHEMBL2979173 0.72 MAPT (0.41) MAPTGAAALDH1A1LMNA
SCHEMBL3100030 0.70 ALDH1A1 (0.41) MAPTGAAALDH1A1LMNA
SCHEMBL2930324 0.70 MAPT (0.38) MAPTGAA
SCHEMBL15865155 0.69 MAPT (0.37) MAPTGAALMNA
SCHEMBL4915107 0.69 GAA (0.37) MAPTGAAALDH1A1
SCHEMBL27427681 0.69 SMN1; SMN2 (0.42) MAPTGAAALDH1A1LMNA

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-0109921-A1 Benzodiazepine receptors and their preparation A/S FERROSAN (DK) 1984-05-30 — — EP disclosed
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