SCHEMBL19679714

SCHEMBL19679714

c1ccc(-c2nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)nc3sc4ccc5c6ccccc6sc5c4c23)cc1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NPY5R Q15761 1/20 0.31
▸ LIMK1 P53667 1/20 0.30
▸ PTGER4 P35408 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
SCHEMBL18674879 0.89 KDM4E (0.38) KDM4EATML3MBTL1NPY5RPTGER4
SCHEMBL18962041 0.88 KDM4E (0.33) KDM4EATML3MBTL1PTGER4
SCHEMBL19758490 0.88 KDM4E (0.35) KDM4EATML3MBTL1NPY5RPTGER4
SCHEMBL18853506 0.87 KDM4E (0.35) KDM4EATML3MBTL1NPY5RPTGER4
SCHEMBL18853415 0.87 KDM4E (0.37) KDM4EATML3MBTL1NPY5RPTGER4
SCHEMBL19758496 0.86 KDM4E (0.33) KDM4EATML3MBTL1NPY5RPTGER4
SCHEMBL19758500 0.86 KDM4E (0.33) KDM4EATML3MBTL1NPY5RPTGER4
SCHEMBL16905628 0.84 KDM4E (0.40) KDM4EATML3MBTL1NPY5RPTGER4
SCHEMBL18962127 0.84 KDM4E (0.33) KDM4EATML3MBTL1PTGER4
SCHEMBL8816998 0.84 ALDH1A1 (0.37) KDM4EATML3MBTL1NPY5RPTGER4

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-20170352447-A1 NOVEL HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SFC CO., LTD. (KR) 2017-12-07 — — US disclosed
US-20170352447-A1 NOVEL HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SFC CO., LTD. (KR) 2017-12-07 — — US disclosed
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