SCHEMBL16095603

SCHEMBL16095603

N#Cc1ccnc(-c2nc(Cc3ccccc3Cl)[nH]c2Br)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ADORA2A P29274 1/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ PHF8 Q9UPP1 2/20 0.36
▸ VNN1 O95497 1/20 0.36
▸ MAPK14 Q16539 4/20 0.36
▸ JAK2 O60674 1/20 0.35
▸ TYK2 P29597 1/20 0.35
▸ METAP2 P50579 1/20 0.34
▸ METAP1 P53582 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34

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
SCHEMBL16095836 0.90 PHF8 (0.39) LMNAMAPTADORA2AADORA1KDM4C
SCHEMBL16095914 0.82 MAPK14 (0.50) MAPTKDM4CMAPK14TGFBR1
SCHEMBL16095079 0.79 ADORA2A (0.39) LMNAMAPTKDM4EADORA2AADORA1
SCHEMBL16095271 0.76 NPY5R (0.34) KDM4CMAPK14METAP2METAP1TGFBR1
SCHEMBL16094449 0.75 USP30 (0.36) MAPK14METAP2METAP1
SCHEMBL16095177 0.75 KDM4C (0.39) LMNAMAPTADORA2AADORA1KDM4C
SCHEMBL16095105 0.74 MAPK14 (0.46) KDM4CPHF8MAPK14
SCHEMBL16033536 0.73 PHF8 (0.60) KDM4CPHF8VNN1MAPK14TSHR
SCHEMBL17604545 0.72 NPY5R (0.37) KDM4CMETAP2METAP1
SCHEMBL16033852 0.72 PHF8 (0.51) KDM4CPHF8VNN1

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
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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