SCHEMBL7978878

SCHEMBL7978878

CCCn1c(OCC(C)C)nc2sc(Cl)cc2c1=O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ TSHR P16473 1/20 0.38
▸ PARG Q86W56 2/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ USP2 O75604 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KIF11 P52732 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ PLA2G7 Q13093 1/20 0.32
▸ PDE5A O76074 1/20 0.31
▸ TP53 P04637 1/20 0.31

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
SCHEMBL193613 0.87 USP2 (0.47) ALDH1A1TSHRCYP1A2CYP2C9SMN1; SMN2
SCHEMBL7966908 0.86 MEN1 (0.38) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL7966994 0.86 USP2 (0.41) L3MBTL1ALDH1A1CYP1A2CYP2C9SMN1; SMN2
SCHEMBL7966894 0.81 SMN1; SMN2 (0.39) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL7977486 0.81 SMN1; SMN2 (0.40) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL7979242 0.81 L3MBTL1 (0.38) L3MBTL1ALDH1A1TSHRCYP1A2CYP2C9
SCHEMBL7980615 0.81 PDE5A (0.39) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL7664876 0.80 ADORA1 (0.34) ALDH1A1CYP1A2CYP2C9SMN1; SMN2USP2
SCHEMBL7979203 0.80 MAPK1 (0.40) L3MBTL1ALDH1A1TSHRCYP1A2CYP2C9
SCHEMBL7665387 0.79 ALDH1A1 (0.33) ALDH1A1PARGCYP1A2CYP2C9SMN1; SMN2

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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