SCHEMBL8789756

SCHEMBL8789756

COc1ccc(CCNCCc2ccc(NC(=O)c3cccc4c(=O)c5c(OC)ccc(OC)c5[nH]c34)cc2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.59
▸ ABCB1 P08183 2/20 0.56
▸ MAPT P10636 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ TP53 P04637 3/20 0.43
▸ THRB P10828 1/20 0.43
▸ CNR1 P21554 1/20 0.43

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
SCHEMBL8789607 0.89 ABCG2 (0.60) ABCG2ABCB1MAPTLMNAL3MBTL1
SCHEMBL8789555 0.88 ABCG2 (0.77) ABCG2ABCB1MAPTLMNAL3MBTL1
SCHEMBL8790186 0.88 ABCG2 (0.59) ABCG2ABCB1MAPTLMNAL3MBTL1
SCHEMBL8790265 0.87 ABCG2 (0.60) ABCG2ABCB1MAPTLMNAL3MBTL1
SCHEMBL8790235 0.87 ABCG2 (0.56) ABCG2ABCB1MAPTLMNAL3MBTL1
SCHEMBL8789736 0.86 ABCG2 (0.55) ABCG2ABCB1MAPTMEN1KMT2A
SCHEMBL8790651 0.86 ABCG2 (0.57) ABCG2ABCB1MAPTLMNAL3MBTL1
SCHEMBL8790484 0.86 ABCG2 (0.57) ABCG2ABCB1MAPTLMNAL3MBTL1
SCHEMBL8789297 0.85 ABCG2 (0.56) ABCG2ABCB1MAPTLMNAL3MBTL1
SCHEMBL8788465 0.85 ABCG2 (0.72) ABCG2ABCB1LMNAL3MBTL1MEN1

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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