SCHEMBL8791520

SCHEMBL8791520

CCN(CCOc1ccc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cc1)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ MAOB P27338 6/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ PBRM1 Q86U86 1/20 0.43
▸ KDR P35968 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.42
▸ MCHR1 Q99705 1/20 0.42
▸ ALK Q9UM73 2/20 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
SCHEMBL8789735 0.90 ABCG2 (0.50) ABCG2TP53MEN1KMT2APBRM1
SCHEMBL8790879 0.84 ABCG2 (0.50) ABCG2TP53MEN1KMT2APBRM1
SCHEMBL8790679 0.84 ABCG2 (0.59) ABCG2TP53MEN1KMT2AMAPT
SCHEMBL8788654 0.82 TP53 (0.48) ABCG2TP53MAOBMEN1KMT2A
SCHEMBL8790584 0.82 ABCG2 (0.52) ABCG2TP53MEN1KMT2APBRM1
SCHEMBL8789743 0.81 ABCG2 (0.58) ABCG2TP53MEN1KMT2APBRM1
SCHEMBL8789120 0.80 ABCG2 (0.63) ABCG2TP53MEN1KMT2AMAPT
SCHEMBL8791527 0.80 ABCG2 (0.51) ABCG2TP53MEN1KMT2APBRM1
SCHEMBL8788702 0.79 ABCG2 (0.59) ABCG2TP53MEN1KMT2AKDR
SCHEMBL8836061 0.78 ABCG2 (0.63) ABCG2TP53MEN1KMT2AMAPT

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
Send feedback