SCHEMBL8788906

SCHEMBL8788906

COc1ccc(CCN(C)CCc2ccc(NC(=O)c3cccc4c(=O)c5ccccc5[nH]c34)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 7/20 0.69
▸ MAPT P10636 3/20 0.56
▸ ABCB1 P08183 2/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ CACNA1B Q00975 1/20 0.49
▸ APBA1 Q02410 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.48
▸ TP53 P04637 2/20 0.47
▸ AKT1 P31749 2/20 0.47
▸ AHR P35869 1/20 0.44

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
SCHEMBL8789166 0.97 ABCG2 (0.65) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8789120 0.95 ABCG2 (0.63) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8836061 0.95 ABCG2 (0.63) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8790125 0.91 ABCG2 (0.65) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8789562 0.90 ABCG2 (0.69) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8789246 0.87 ABCG2 (0.66) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8790679 0.87 ABCG2 (0.59) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8789962 0.87 ABCG2 (0.65) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8789541 0.86 ABCG2 (0.65) ABCG2MAPTABCB1MEN1KMT2A
SCHEMBL8790216 0.86 ABCG2 (0.62) ABCG2MAPTABCB1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0569380-B1 ACRIDINE DERIVATIVES GLAXO LAB SA (FR) 1997-05-28 — — EP claimed
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 claimed
EP-0569380-A1 ACRIDINE DERIVATIVES. GLAXO LAB SA (FR) 1993-11-18 — — EP claimed
WO-1992012132-A1 ACRIDINE DERIVATIVES LABORATOIRES GLAXO S.A. (FR) 1992-07-23 — — WO claimed
EP-0494623-A1 Acridine derivatives LABORATOIRES GLAXO SA (FR) 1992-07-15 — — EP claimed
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-0569380-A1 ACRIDINE DERIVATIVES. GLAXO LAB SA (FR) 1993-11-18 — — EP disclosed
WO-1992012132-A1 ACRIDINE DERIVATIVES LABORATOIRES GLAXO S.A. (FR) 1992-07-23 — — WO disclosed
EP-0494623-A1 Acridine derivatives LABORATOIRES GLAXO SA (FR) 1992-07-15 — — EP disclosed
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