SCHEMBL8789922

SCHEMBL8789922

COc1ccc(CCNCCCCCc2ccc(NC(=O)c3cccc4c(=O)c5cccc(F)c5[nH]c34)cc2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.55
▸ ABCB1 P08183 3/20 0.51
▸ TP53 P04637 2/20 0.44
▸ SLC2A1 P11166 1/20 0.44
▸ ADRB2 P07550 1/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ ADRB3 P13945 1/20 0.42
▸ MAPT P10636 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 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
SCHEMBL8789297 0.99 ABCG2 (0.56) ABCG2ABCB1TP53SLC2A1ADRB2
SCHEMBL8790484 0.97 ABCG2 (0.57) ABCG2ABCB1TP53SLC2A1ADRB2
SCHEMBL8789607 0.95 ABCG2 (0.60) ABCG2ABCB1TP53ADRB2ADRB1
SCHEMBL8791640 0.91 ABCG2 (0.56) ABCG2ABCB1TP53ADRB2ADRB1
SCHEMBL8790540 0.91 ABCG2 (0.55) ABCG2ABCB1TP53ADRB2ADRB1
SCHEMBL8835766 0.90 ABCG2 (0.70) ABCG2ABCB1SLC2A1LMNAL3MBTL1
SCHEMBL8790235 0.90 ABCG2 (0.56) ABCG2ABCB1SLC2A1ADRB2MAPT
SCHEMBL8790209 0.90 ABCG2 (0.59) ABCG2ABCB1TP53ADRB2ADRB1
SCHEMBL8790088 0.89 ABCG2 (0.53) ABCG2ABCB1TP53ADRB2ADRB1
SCHEMBL8790024 0.89 ABCG2 (0.71) ABCG2ABCB1SLC2A1LMNAL3MBTL1

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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