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Sugi Predict / Compounds / SCHEMBL7811686

SCHEMBL7811686

SCHEMBL7811686

CCCCc1nc(C)c(CCC(=O)N2CCOCC2)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 4/20 0.61
▸ PPARG P37231 1/20 0.53

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
SCHEMBL7821959 0.94 AGTR1 (0.66) AGTR1PPARG
SCHEMBL7821306 0.94 AGTR1 (0.59) AGTR1
SCHEMBL7811003 0.93 AGTR1 (0.60) AGTR1
SCHEMBL7818942 0.93 AGTR1 (0.60) AGTR1
SCHEMBL7810802 0.93 AGTR1 (0.60) AGTR1
SCHEMBL6978910 0.92 AGTR1 (0.68) AGTR1
SCHEMBL7812897 0.92 AGTR1 (0.53) AGTR1
SCHEMBL7811655 0.92 AGTR1 (0.52) AGTR1
SCHEMBL7821038 0.91 PPARG (0.53) AGTR1PPARG
SCHEMBL7823816 0.89 PPARG (0.51) PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0781276-B1 PYRIMIDINONE DERIVATIVES BORYUNG PHARM (KR) 2001-12-12 — — EP claimed
EP-0781276-A1 PYRIMIDINONE DERIVATIVES BORYUNG PHARMACEUTICAL CO., LTD. (KR) 1997-07-02 — — EP claimed
WO-1996008476-A1 PYRIMIDINONE DERIVATIVES BORYUNG PHARMACEUTICAL CO., LTD. (KR) 1996-03-21 — — WO claimed
EP-0781276-B1 PYRIMIDINONE DERIVATIVES BORYUNG PHARM (KR) 2001-12-12 — — EP disclosed
EP-0781276-A1 PYRIMIDINONE DERIVATIVES BORYUNG PHARMACEUTICAL CO., LTD. (KR) 1997-07-02 — — EP disclosed
WO-1996008476-A1 PYRIMIDINONE DERIVATIVES BORYUNG PHARMACEUTICAL CO., LTD. (KR) 1996-03-21 — — WO disclosed