Sugi Predict

Sugi Predict / Compounds / SCHEMBL13005158

SCHEMBL13005158

SCHEMBL13005158

Cn1ccc2cc(-c3ccccc3Oc3ncccn3)cnc21

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 14/20 0.48
▸ FEN1 P39748 14/20 0.48
▸ PDGFRB P09619 1/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ APP P05067 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ PIK3CA P42336 1/20 0.39
▸ MTOR P42345 1/20 0.39
▸ ATR Q13535 1/20 0.37

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
SCHEMBL13538546 0.86 ALOX5AP (0.48) ALOX5APFEN1PDGFRBPDGFRAMAOB
SCHEMBL13005165 0.83 ALOX5AP (0.44) ALOX5APFEN1PDGFRBPDGFRAMAOB
SCHEMBL3348850 0.83 FEN1 (0.43) ALOX5APFEN1PDGFRBPDGFRAMAOB
SCHEMBL24394780 0.75 HCRTR1 (0.41) ALOX5APFEN1
SCHEMBL30545131 0.75 HCRTR1 (0.41) ALOX5APFEN1
SCHEMBL14467094 0.74 APP (0.49) PDGFRBPDGFRAAPPPIK3CAMTOR
SCHEMBL17362187 0.74 APP (0.47) APPPIK3CAMTORATR
SCHEMBL3355653 0.73 FEN1 (0.81) ALOX5APFEN1PIK3CA
SCHEMBL30545105 0.72 ADRA2A (0.41) ALOX5APFEN1
SCHEMBL24394713 0.72 ADRA2A (0.41) ALOX5APFEN1

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-1633750-B1 SYNTHESIS OF 5-SUBSTITUTED 7-AZAINDOLES AND 7-AZAINDOLINES EISAI R&D MAN CO LTD (JP) 2010-12-01 — — EP disclosed
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