SCHEMBL12473352

SCHEMBL12473352

CN(C)C(CCN)c1nc(-c2cc3ccccc3o2)nc2cc(C(F)(F)F)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F7 P08709 1/20 0.33
▸ F3 P13726 1/20 0.33
▸ F2RL3 Q96RI0 4/20 0.33
▸ PRMT7 Q9NVM4 1/20 0.32
▸ CTNNB1 P35222 1/20 0.32
▸ TCF7L2 Q9NQB0 1/20 0.32
▸ ADORA2A P29274 1/20 0.31
▸ ADORA1 P30542 1/20 0.31
▸ C1R P00736 1/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ CNR2 P34972 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ GRM4 Q14833 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
SCHEMBL12473284 0.93 PRMT7 (0.34) F2RL3PRMT7CTNNB1TCF7L2ADORA2A
SCHEMBL12473407 0.88 CNR2 (0.37) F2RL3PRMT7CTNNB1TCF7L2ADORA2A
SCHEMBL12473319 0.87 PRMT7 (0.35) F2RL3PRMT7CTNNB1TCF7L2ADORA2A
SCHEMBL12473280 0.87 F2RL3 (0.37) F2RL3PRMT7ADORA2AADORA1NPC1
SCHEMBL12473398 0.86 PDE10A (0.37) F2RL3PRMT7ADORA2AADORA1NPC1
SCHEMBL12473316 0.86 MAOB (0.38) F2RL3PRMT7CTNNB1TCF7L2ADORA2A
SCHEMBL12473403 0.86 BCHE (0.34) F2RL3PRMT7ADORA2AADORA1NPC1
SCHEMBL12473317 0.84 KDM4E (0.42) NPC1KDM4EALDH1A1MAPTHPGD
SCHEMBL12473438 0.82 F2RL3 (0.33) F2RL3PRMT7ADORA2AADORA1NPC1
SCHEMBL12473199 0.82 CNR2 (0.37) F2RL3PRMT7CTNNB1TCF7L2ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012046207-A1 ANTI-PARASITIC SUBSTITUTED RING FUSED AZINE COMPOUNDS PARACO TECHNOLOGY LIMITED (NZ) 2012-04-12 — — WO disclosed
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