SCHEMBL27807772

SCHEMBL27807772

NC(=O)c1ccccc1-c1ncncc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCAT2 O15382 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ CSNK1A1 P48729 2/20 0.44
▸ TYRO3 Q06418 2/20 0.44
▸ DYRK1B Q9Y463 2/20 0.44
▸ RAB9A P51151 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ NUDT1 P36639 1/20 0.40
▸ DAPK3 O43293 1/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ PAK4 O96013 1/20 0.39
▸ ABL1 P00519 1/20 0.39
▸ CSF1R P07333 1/20 0.39

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
SCHEMBL27647695 0.76 BCAT2 (0.47) BCAT2KDM4EALDH1A1MAPTHPGD
SCHEMBL4243215 0.75 BCAT2 (0.63) BCAT2KDM4EALDH1A1MAPTHPGD
SCHEMBL30716388 0.73 BCAT2 (0.61) BCAT2KDM4EALDH1A1MAPTHPGD
SCHEMBL28109352 0.73 PARP1 (0.46) BCAT2KDM4EALDH1A1CSNK1A1TYRO3
SCHEMBL30315919 0.72 BCAT2 (0.46) BCAT2KDM4EALDH1A1DYRK1BMAP2K1
SCHEMBL16654579 0.71 BCAT2 (0.53) BCAT2KDM4EALDH1A1MAPTHPGD
SCHEMBL210767 0.71 BCAT2 (0.74) BCAT2KDM4EALDH1A1MAPTHPGD
SCHEMBL30514077 0.71 BCAT2 (0.74) BCAT2KDM4EALDH1A1MAPTHPGD
SCHEMBL31227695 0.71 CSNK1A1 (0.57) BCAT2KDM4EALDH1A1MAPTHPGD
SCHEMBL997870 0.71 CSNK1A1 (0.57) BCAT2KDM4EALDH1A1MAPTHPGD

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
CN-102712619-A 5-hydroxypyrimidine-4-carboxamide derivative DAIICHI SANKYO CO LTD 2012-10-03 — — CN disclosed
CN-102066337-A 5-hydroxypyrimidine-4-carboxamide compounds DAIICHI SANKYO CO LTD 2011-05-18 — — CN disclosed
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