SCHEMBL30643545

SCHEMBL30643545

O=c1c2ccccc2n2c3c(cccc13)Sc1ccccc1-2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 12/20 0.43
▸ MAOA P21397 1/20 0.43
▸ ACHE P22303 3/20 0.40
▸ P2RX4 Q99571 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ SLC6A3 Q01959 2/20 0.38
▸ NOX1 Q9Y5S8 1/20 0.38
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ GLA P06280 1/20 0.36

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
SCHEMBL29087114 1.00 BCHE (0.43) BCHEMAOAACHEP2RX4ALDH1A1
SCHEMBL30643546 1.00 BCHE (0.43) BCHEMAOAACHEP2RX4ALDH1A1
SCHEMBL29767396 0.86 BCHE (0.44) BCHEMAOAACHEALDH1A1SLC6A3
SCHEMBL19035944 0.86 BCHE (0.44) BCHEMAOAACHEALDH1A1SLC6A3
SCHEMBL26453154 0.84 ACHE (0.40) BCHEMAOAACHEALDH1A1SLC6A3
SCHEMBL26453129 0.81 BCHE (0.48) BCHEMAOAACHEALDH1A1MAPT
SCHEMBL12181303 0.79 TDP1 (0.46) BCHEMAOAACHESLC6A3NOX1
SCHEMBL24608665 0.78 PGR (0.41) BCHEMAOAACHEALDH1A1
SCHEMBL20976182 0.76 BCHE (0.39) BCHEMAOAACHESLC6A3NOX1
SCHEMBL18534090 0.76 L3MBTL1 (0.40) BCHEMAOAACHEALDH1A1SLC6A3

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
CN-116887650-A Preparation method of organic crystal film device by melt phase transformation 季华实验室 2023-10-13 — — CN disclosed
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