SCHEMBL16094923

SCHEMBL16094923

N#Cc1ccnc(-c2c[nH]c(CCc3cccc4ccccc34)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHF8 Q9UPP1 5/20 0.43
▸ ADRA2A P08913 3/20 0.38
▸ ADRA2B P18089 3/20 0.38
▸ ADRA2C P18825 3/20 0.38
▸ KDM4C Q9H3R0 3/20 0.38
▸ KDM4A O75164 1/20 0.38
▸ DAO P14920 1/20 0.37
▸ KDM2B Q8NHM5 1/20 0.36
▸ MCL1 Q07820 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ ADRA1A P35348 2/20 0.34
▸ ADRA1D P25100 1/20 0.34
▸ ADRA1B P35368 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAPK1 P28482 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
SCHEMBL17604567 0.89 PHF8 (0.42) PHF8ADRA2AADRA2BADRA2CKDM4C
SCHEMBL16095066 0.85 PHF8 (0.41) PHF8KDM4CLMNAMAPTMAPK1
SCHEMBL16095234 0.83 PHF8 (0.40) PHF8KDM4CDAOKDM2BOPRK1
SCHEMBL16095150 0.82 PHF8 (0.41) PHF8ADRA2AADRA2BADRA2CKDM4C
SCHEMBL16094800 0.79 KDM4C (0.61) PHF8KDM4CKDM4A
SCHEMBL16095691 0.78 FAAH (0.46) KDM4CLMNACYP2D6MAPK1
SCHEMBL16095079 0.77 ADORA2A (0.39) PHF8KDM4CLMNAMAPTMAPK1
SCHEMBL16095409 0.77 KDM4C (0.65) PHF8KDM4CKDM2B
SCHEMBL16034591 0.76 PHF8 (0.68) PHF8KDM4CKDM4AKDM2B
SCHEMBL16095813 0.76 PHF8 (0.39) PHF8KDM4CLMNAMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3193881-A1 HISTONE DEMETHYLASE INHIBITORS Celgene Quanticel Research, Inc. (US) 2017-07-26 — — EP disclosed
WO-2016044342-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2016-03-24 — — WO disclosed
EP-2969007-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 — — EP disclosed
WO-2014151945-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 — — WO disclosed
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