SCHEMBL13935915

SCHEMBL13935915

Clc1ccc2sc3c4ccccc4cc4c5c6cc(Cl)ccc6sc6c7ccccc7cc(c(c2c1)c43)c65

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.47
▸ PIM1 P11309 6/20 0.39
▸ PIM2 Q9P1W9 4/20 0.39
▸ IDO1 P14902 1/20 0.38
▸ CYP1B1 Q16678 3/20 0.37
▸ CYP1A1 P04798 2/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ CYP2A6 P11509 2/20 0.36
▸ HRH4 Q9H3N8 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ROCK1 Q13464 1/20 0.33
▸ TOP1 P11387 1/20 0.33
▸ TOP2A P11388 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ RXFP1 Q9HBX9 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
SCHEMBL24951364 0.82 KDM4E (0.43) KDM4EPIM1PIM2IDO1CYP1B1
SCHEMBL24952196 0.81 KDM4E (0.46) KDM4EPIM1PIM2IDO1CYP1B1
SCHEMBL22127109 0.80 KDM4E (0.53) KDM4EPIM1PIM2IDO1CYP1A2
SCHEMBL25733722 0.80 KDM4E (0.50) KDM4EPIM1PIM2IDO1CYP1B1
SCHEMBL22892674 0.78 KDM4E (0.47) KDM4EPIM1PIM2IDO1CYP1B1
SCHEMBL23024877 0.78 CYP1A1 (0.51) KDM4EPIM1PIM2IDO1CYP1B1
SCHEMBL22174349 0.76 KDM4E (0.56) KDM4EPIM1PIM2IDO1CYP1B1
SCHEMBL24952193 0.76 AHR (0.40) KDM4EPIM1PIM2IDO1CYP1B1
SCHEMBL24223785 0.76 KDM4E (0.37) KDM4EPIM1PIM2IDO1CYP1B1
SCHEMBL13562027 0.75 CYP2A6 (0.44) KDM4EPIM1PIM2IDO1CYP1B1

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-7494721-B2 Light-emitting device, condensed polycyclic compound used therein and method for producing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-02-24 — — US disclosed
US-7494721-B2 Light-emitting device, condensed polycyclic compound used therein and method for producing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-02-24 — — US disclosed
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