SCHEMBL8206430

SCHEMBL8206430

CCCC(Sc1c2ccccc2nc2cc(N)ccc12)Sc1c2ccccc2nc2cc(N)ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.44
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
TERT O14746 1/20 0.40
ABCB11 O95342 1/20 0.40
THRB P10828 1/20 0.40
BLM P54132 1/20 0.40
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 4/20 0.39
GAA P10253 2/20 0.39
HTR3A P46098 1/20 0.39
KCNH2 Q12809 2/20 0.38
MDM4 O15151 1/20 0.37
CASP1 P29466 3/20 0.37
CASP7 P55210 3/20 0.37
HSD17B10 Q99714 3/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL8212730 0.82 KDM1A (0.50) KDM1AKMT2AMEN1LMNATERT
SCHEMBL8212483 0.80 TLR8 (0.39) KDM1AKMT2ALMNAKDM4EALDH1A1
SCHEMBL3362993 0.80 KDM1A (0.43) KDM1AKMT2AMEN1LMNATERT
SCHEMBL7869229 0.76 KDM1A (0.53) KDM1AKMT2AMEN1LMNATERT
SCHEMBL8207048 0.75 ALDH1A1 (0.47) KDM1AKMT2ALMNAKDM4EALDH1A1
SCHEMBL11703072 0.74 KDM4E (0.51) KDM1AKMT2AMEN1LMNATERT
SCHEMBL7875795 0.73 KDM1A (0.50) KDM1AKMT2AMEN1LMNATERT
SCHEMBL11703562 0.72 KDM4E (0.58) KMT2AMEN1LMNATERTABCB11
SCHEMBL3362999 0.72 MEN1 (0.46) KDM1AKMT2AMEN1LMNATERT
SCHEMBL11703495 0.72 HTR3A (0.52) KDM1AKMT2AMEN1LMNATERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0979078-A4 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORP (US) 2000-06-21 EP claimed
EP-0979078-A1 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2000-02-16 EP claimed
WO-1998030218-A1 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 1998-07-16 WO claimed
EP-0979078-A4 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORP (US) 2000-06-21 EP disclosed
EP-0979078-A1 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2000-02-16 EP disclosed
WO-1998030218-A1 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 1998-07-16 WO disclosed