SCHEMBL20107148

SCHEMBL20107148

CCc1cc(C)cc(-c2ccc3ccc4c(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)ccc5ccc2c3c54)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C4 P17516 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
PRSS1 P07477 1/20 0.32
MAPT P10636 2/20 0.31
PTGER4 P35408 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HKDC1 Q2TB90 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL9920675 0.90 KDM4E (0.40) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E
SCHEMBL20058306 0.89 KDM4E (0.37) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E
SCHEMBL20107149 0.87 KDM4E (0.34) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E
SCHEMBL20058352 0.86 AKR1C4 (0.36) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E
SCHEMBL9920771 0.85 L3MBTL1 (0.40) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E
SCHEMBL20058327 0.84 KDM4E (0.36) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E
SCHEMBL9920625 0.83 L3MBTL1 (0.43) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E
SCHEMBL9921080 0.83 L3MBTL1 (0.43) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E
SCHEMBL13872178 0.82 RXFP1 (0.42) KDM4EATML3MBTL1MAPTRXFP1
SCHEMBL9920973 0.82 L3MBTL1 (0.35) AKR1C4AKR1C3AKR1C2AKR1C1KDM4E

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-2463352-B1 Light emitting device material and light emitting device TORAY INDUSTRIES (JP) 2018-05-02 EP disclosed