SCHEMBL7966908

SCHEMBL7966908

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

nearest known ligand 0.38

Predicted protein targets (top 17)

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 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ KIF11 P52732 1/20 0.33
▸ 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
SCHEMBL194662 0.87 USP2 (0.47) L3MBTL1ALDH1A1TSHRCYP1A2CYP2C9
SCHEMBL7978878 0.86 MEN1 (0.38) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL7983018 0.86 USP2 (0.41) L3MBTL1ALDH1A1TSHRCYP1A2CYP2C9
SCHEMBL7980392 0.81 SMN1; SMN2 (0.39) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL7966922 0.81 L3MBTL1 (0.38) L3MBTL1ALDH1A1TSHRCYP1A2CYP2C9
SCHEMBL7978890 0.81 SMN1; SMN2 (0.40) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL7667264 0.81 PARG (0.37) ALDH1A1PARGCYP1A2CYP2C9SMN1; SMN2
SCHEMBL7980723 0.81 PDE5A (0.39) MEN1KMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL7670733 0.80 ADORA1 (0.34) ALDH1A1CYP1A2CYP2C9SMN1; SMN2USP2
SCHEMBL7980691 0.80 MAPK1 (0.40) L3MBTL1ALDH1A1TSHRCYP1A2CYP2C9

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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