SCHEMBL7983018

SCHEMBL7983018

CCCCOc1nc2sc(Br)cc2c(=O)n1CCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.41
▸ ALDH1A1 P00352 6/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ NPY1R P25929 1/20 0.37
▸ NPY2R P49146 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ ADORA2A P29274 5/20 0.34
▸ PDE4A P27815 4/20 0.34
▸ PDE4B Q07343 3/20 0.34
▸ PDE4C Q08493 3/20 0.34
▸ PDE4D Q08499 3/20 0.34
▸ HPGD P15428 2/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 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
SCHEMBL7966922 0.95 L3MBTL1 (0.38) USP2ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL194662 0.94 USP2 (0.47) USP2ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL7980691 0.92 MAPK1 (0.40) USP2ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL7980723 0.87 PDE5A (0.39) ALDH1A1SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL7966908 0.86 MEN1 (0.38) USP2ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL7966994 0.85 USP2 (0.41) USP2ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL7667264 0.83 PARG (0.37) USP2ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL7670733 0.82 ADORA1 (0.34) USP2ALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL7691943 0.81 PARG (0.36) ALDH1A1SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL7980392 0.81 SMN1; SMN2 (0.39) USP2ALDH1A1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888359-A1 PYRIMIDIN-4-ONE DERIVATIVES AS PESTICIDE Novartis AG (CH) 1999-01-07 — — EP claimed
WO-1997033890-A1 PYRIMIDIN-4-ONE DERIVATIVES AS PESTICIDE NOVARTIS AG (CH) 1997-09-18 — — WO claimed
US-6262058-B1 Pyrimidin-4-one derivatives as pesticide SYNGENTA CROP PROTECTION, INC. 2001-07-17 — — US disclosed
EP-0888359-A1 PYRIMIDIN-4-ONE DERIVATIVES AS PESTICIDE Novartis AG (CH) 1999-01-07 — — EP disclosed
WO-1997033890-A1 PYRIMIDIN-4-ONE DERIVATIVES AS PESTICIDE NOVARTIS AG (CH) 1997-09-18 — — WO disclosed
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