SCHEMBL8789751

SCHEMBL8789751

COc1ccc(CCNCCOc2ccc(NC(=O)c3cccc4c(=O)c5ccccc5[nH]c34)cc2)cc1OC

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.69
▸ LMNA P02545 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ ABCB1 P08183 2/20 0.48
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ AKT1 P31749 2/20 0.44
▸ APP P05067 1/20 0.43
▸ PARP14 Q460N5 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42

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
SCHEMBL8789900 0.98 ABCG2 (0.68) ABCG2LMNAL3MBTL1ABCB1MEN1
SCHEMBL8790230 0.95 ABCG2 (0.66) ABCG2LMNAL3MBTL1ABCB1MEN1
SCHEMBL8789555 0.93 ABCG2 (0.77) ABCG2LMNAL3MBTL1ABCB1MEN1
SCHEMBL8790688 0.91 ABCG2 (0.70) ABCG2ABCB1MEN1KMT2ATP53
SCHEMBL8789706 0.91 ABCG2 (0.62) ABCG2LMNAL3MBTL1ABCB1MEN1
SCHEMBL8835762 0.91 ABCG2 (0.56) ABCG2LMNAL3MBTL1ABCB1MEN1
SCHEMBL8789476 0.90 ABCG2 (0.55) ABCG2LMNAL3MBTL1MEN1KMT2A
SCHEMBL8788465 0.90 ABCG2 (0.72) ABCG2LMNAL3MBTL1ABCB1MEN1
SCHEMBL8790060 0.90 ABCG2 (0.72) ABCG2LMNAL3MBTL1ABCB1MEN1
SCHEMBL8790024 0.89 ABCG2 (0.71) ABCG2LMNAL3MBTL1ABCB1MEN1

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 8 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-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
Send feedback