SCHEMBL16095813

SCHEMBL16095813

N#Cc1ccnc(-c2c[nH]c(Cc3cccc(Cl)c3Cl)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHF8 Q9UPP1 6/20 0.39
▸ JAK2 O60674 1/20 0.36
▸ TYK2 P29597 1/20 0.36
▸ KDM4C Q9H3R0 2/20 0.34
▸ VNN1 O95497 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ MPO P05164 2/20 0.32
▸ NPY5R Q15761 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.32
▸ P2RX7 Q99572 1/20 0.32

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
SCHEMBL16095079 0.91 ADORA2A (0.39) PHF8JAK2TYK2KDM4CVNN1
SCHEMBL17604542 0.90 PHF8 (0.39) PHF8KDM4CPTPN11MAPK1P2RX7
SCHEMBL16095001 0.87 TAAR1 (0.44) JAK2TYK2KDM4CNPY5RHRH3
SCHEMBL16095102 0.86 PHF8 (0.41) PHF8KDM4CNPY5RP2RX7
SCHEMBL16095066 0.83 PHF8 (0.41) PHF8KDM4CVNN1ADORA2AADORA1
SCHEMBL16095540 0.81 GRM5 (0.43) VNN1POLBHRH3
SCHEMBL17604574 0.80 PHF8 (0.37) PHF8KDM4CPTPN11MAPK1P2RX7
SCHEMBL16094887 0.79 TSHR (0.37) VNN1NPY5RTSHRHRH3IDH1
SCHEMBL17604563 0.78 KDM5B (0.41) PHF8KDM4CPOLBL3MBTL1
SCHEMBL27967633 0.77 IDO1 (0.42) PTPN11MAPK1P2RX7

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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