SCHEMBL13906473

SCHEMBL13906473

CC1C=c2c([nH]c3c(=O)oc4ncccc4c23)=CC1F

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL13906466 0.74 KDM4E (0.30) KDM4EALDH1A1
SCHEMBL13906474 0.68 MAPT (0.38) KDM4EALDH1A1
SCHEMBL829831 0.66 CDK5 (0.37) KDM4EALDH1A1
SCHEMBL832080 0.64 CDK5 (0.35) KDM4EALDH1A1
SCHEMBL12665725 0.64 CDK5 (0.41) KDM4EALDH1A1
SCHEMBL12388707 0.61 AURKA (0.35) KDM4EALDH1A1
SCHEMBL12622957 0.61 CDK4 (0.39) KDM4EALDH1A1
SCHEMBL13395672 0.61 CDK4 (0.36) KDM4EALDH1A1
SCHEMBL12388717 0.60 PARP1 (0.40) KDM4EALDH1A1
SCHEMBL16751651 0.58 AURKA (0.42) KDM4EALDH1A1

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
WO-2009032123-A2 TETRACYCLIC INDOLE DERIVATIVES AND THEIR USE FOR TREATING OR PREVENTING VIRAL INFECTIONS SCHERING CORPORATION (US) 2009-03-12 — — WO disclosed
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