SCHEMBL8790888

SCHEMBL8790888

Cc1ccc(CCNCCOc2ccc(NC(=O)c3cccc4c(=O)c5ccccc5[nH]c34)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.60
▸ TP53 P04637 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ MAPT P10636 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.43
▸ AKT1 P31749 2/20 0.42
▸ ABCB1 P08183 2/20 0.42
▸ MCL1 Q07820 2/20 0.41
▸ CFTR P13569 1/20 0.41
▸ PBRM1 Q86U86 1/20 0.41

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
SCHEMBL8790688 0.93 ABCG2 (0.70) ABCG2TP53KDM4EKMT2AMEN1
SCHEMBL8789743 0.93 ABCG2 (0.58) ABCG2TP53KDM4EKMT2AMEN1
SCHEMBL8788669 0.91 ABCG2 (0.57) ABCG2TP53KDM4EKMT2AMEN1
SCHEMBL8789125 0.88 ABCG2 (0.65) ABCG2TP53KDM4EKMT2AMEN1
SCHEMBL8789751 0.88 ABCG2 (0.69) ABCG2TP53KDM4EKMT2AMEN1
SCHEMBL8836072 0.87 ABCG2 (0.66) ABCG2TP53KDM4EKMT2AMEN1
SCHEMBL8789900 0.86 ABCG2 (0.68) ABCG2TP53KMT2AMEN1MAPT
SCHEMBL8788917 0.84 ABCG2 (0.72) ABCG2TP53KDM4EKMT2AMEN1
SCHEMBL8790131 0.84 ABCG2 (0.72) ABCG2TP53KDM4EKMT2AMEN1
SCHEMBL8790879 0.84 ABCG2 (0.50) ABCG2TP53KDM4EKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0569380-B1 ACRIDINE DERIVATIVES GLAXO LAB SA (FR) 1997-05-28 — — EP disclosed
US-5604237-A IMPROVE OR INCREASE EFFICACY OF ANTITUMOR AGENT, INCREASE OR RESTORE SENSITIVITY OF TUMOR TO ANTITUMOR AGENT, REVERSE OR REDUCE RESISTANCE OF TUMOR TO ANTITUMOR AGENT LABORATOIRES GLAXO SA (FR) 1997-02-18 — — US disclosed
EP-0494623-A1 Acridine derivatives LABORATOIRES GLAXO SA (FR) 1992-07-15 — — EP disclosed
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