SCHEMBL7488455

SCHEMBL7488455

Cc1ccc2c(c1)C=Cc1cc(C)ccc1C2c1c[nH]c(=O)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ATAD2 Q6PL18 1/20 0.40
▸ POLB P06746 3/20 0.39
▸ LMNA P02545 2/20 0.38
▸ P2RY2 P41231 3/20 0.38
▸ ALDH1A1 P00352 4/20 0.37
▸ KDM4E B2RXH2 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ DPYD Q12882 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL7840803 0.93 ATAD2 (0.38) ATAD2POLBLMNAP2RY2ALDH1A1
SCHEMBL7486706 0.92 P2RY2 (0.37) ATAD2POLBLMNAP2RY2ALDH1A1
SCHEMBL7491592 0.91 ALDH1A1 (0.45) POLBLMNAP2RY2ALDH1A1KDM4E
SCHEMBL7490690 0.90 P2RY2 (0.40) POLBLMNAP2RY2ALDH1A1KDM4E
SCHEMBL7491074 0.90 P2RY2 (0.34) ATAD2POLBLMNAP2RY2ALDH1A1
SCHEMBL7841473 0.89 LMNA (0.37) ATAD2POLBLMNAP2RY2ALDH1A1
SCHEMBL7491391 0.88 P2RY2 (0.39) POLBLMNAP2RY2ALDH1A1KDM4E
SCHEMBL7840949 0.88 P2RY2 (0.39) POLBLMNAP2RY2ALDH1A1KDM4E
SCHEMBL7841890 0.88 LMNA (0.36) ATAD2POLBLMNAP2RY2ALDH1A1
SCHEMBL7503494 0.86 LMNA (0.33) ATAD2POLBLMNAP2RY2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0996617-B1 2,4-Dithi(oxo)-pyridin-5-yl compounds bearing a tricyclic substituent useful as P2 purinoceptor antagonists ASTRAZENECA AB (SE) 2002-01-09 — — EP disclosed
EP-0984963-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-04-11 — — EP disclosed
US-6162808-A Compounds ASTRAZENECA U.K. LIMITED (GB) 2000-12-19 — — US disclosed
US-6107297-A 2,4-Dithi(oxo)-pyrimidin-5-yl compounds bearing a tricyclic substituent useful as P2 purinoceptor antagonists ASTRA PHARMACEUTICALS LIMITED (GB) 2000-08-22 — — US disclosed
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