SCHEMBL7840803

SCHEMBL7840803

Cc1ccc2c(c1)C=Cc1cc(C)c(C)cc1C2c1c[nH]c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ATAD2 Q6PL18 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ P2RY2 P41231 5/20 0.35
▸ POLB P06746 3/20 0.35
▸ ALDH1A1 P00352 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL7488455 0.93 ATAD2 (0.40) ATAD2LMNAP2RY2POLBALDH1A1
SCHEMBL7841890 0.89 LMNA (0.36) ATAD2LMNAP2RY2POLBALDH1A1
SCHEMBL7486706 0.86 P2RY2 (0.37) ATAD2LMNAP2RY2POLBALDH1A1
SCHEMBL7841473 0.85 LMNA (0.37) ATAD2LMNAP2RY2POLBALDH1A1
SCHEMBL7491592 0.85 ALDH1A1 (0.45) LMNAP2RY2POLBALDH1A1KDM4E
SCHEMBL7491074 0.84 P2RY2 (0.34) ATAD2LMNAP2RY2POLBALDH1A1
SCHEMBL7490690 0.84 P2RY2 (0.40) LMNAP2RY2POLBALDH1A1KDM4E
SCHEMBL7491391 0.82 P2RY2 (0.39) LMNAP2RY2POLBALDH1A1KDM4E
SCHEMBL7840949 0.82 P2RY2 (0.39) LMNAP2RY2POLBALDH1A1KDM4E
SCHEMBL7489122 0.81 CA12 (0.36) LMNAP2RY2POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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