SCHEMBL13045265

SCHEMBL13045265

c1ccc2c(-c3cnc4ncc(-c5c6ccccc6cc6ccccc56)cc4c3)c3ccccc3cc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.50
▸ NISCH Q9Y2I1 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ MGAM O43451 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ SI P14410 1/20 0.39
▸ MGAM2 Q2M2H8 1/20 0.39
▸ PDGFRB P09619 2/20 0.37
▸ PDGFRA P16234 2/20 0.37
▸ ESR1 P03372 3/20 0.37
▸ ESR2 Q92731 3/20 0.37
▸ NQO2 P16083 1/20 0.37
▸ TOP2A P11388 1/20 0.36
▸ TOP2B Q02880 1/20 0.36
▸ CYP11B1 P15538 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ CYP1B1 Q16678 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL17899275 0.87 KDM4E (0.45) ALOX5NISCHKDM4EMGAMGAA
SCHEMBL13045266 0.79 CYP11B1 (0.54) NISCHKDM4EPDGFRBPDGFRATOP2A
SCHEMBL170247 0.75 ALOX5 (0.62) ALOX5ESR1ESR2NQO2CYP11B1
SCHEMBL29349888 0.75 ALOX5 (0.62) ALOX5ESR1ESR2NQO2CYP11B1
SCHEMBL28353300 0.75 ALOX5 (0.62) ALOX5NISCHESR1ESR2NQO2
SCHEMBL6684079 0.75 ALOX5 (0.62) ALOX5NISCHESR1ESR2NQO2
SCHEMBL13979072 0.74 PDGFRB (0.50) ALOX5NISCHKDM4EPDGFRBPDGFRA
SCHEMBL27950152 0.74 ALOX5 (0.59) ALOX5NISCHKDM4EMGAMGAA
SCHEMBL27916683 0.74 ALOX5 (0.60) ALOX5ESR1ESR2NQO2ALDH1A1
SCHEMBL13979068 0.73 PDGFRB (0.53) NISCHKDM4EPDGFRBPDGFRAESR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7833634-B2 1,8-naphthyridine compound and organic light-emitting device using the same CANON KABUSHIKI KAISHA (JP) 2010-11-16 — — US disclosed
US-7833634-B2 1,8-naphthyridine compound and organic light-emitting device using the same CANON KABUSHIKI KAISHA (JP) 2010-11-16 — — US disclosed
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