SCHEMBL6442706

SCHEMBL6442706

COc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1NC(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 13/20 0.82
KMT2A Q03164 13/20 0.82
MAPT P10636 9/20 0.82
IDH1 O75874 2/20 0.63
MAPK1 P28482 3/20 0.62
TP53 P04637 2/20 0.62
GAA P10253 1/20 0.62
NPSR1 Q6W5P4 2/20 0.60
POLB P06746 2/20 0.60
TSHR P16473 1/20 0.60
CASP1 P29466 1/20 0.60
HSD17B10 Q99714 1/20 0.60
ALDH1A1 P00352 4/20 0.59
CASP3 P42574 1/20 0.58
SENP7 Q9BQF6 1/20 0.58
SENP6 Q9GZR1 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
HTT P42858 2/20 0.58
LMNA P02545 2/20 0.58
USP2 O75604 1/20 0.58

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
SCHEMBL12316787 0.94 KMT2A (0.82) MEN1KMT2AMAPTIDH1MAPK1
SCHEMBL8345735 0.88 MEN1 (0.70) MEN1KMT2AMAPTMAPK1TP53
SCHEMBL13556626 0.87 KMT2A (0.71) MEN1KMT2AMAPTIDH1MAPK1
SCHEMBL6441408 0.86 MAPT (0.76) MEN1KMT2AMAPTMAPK1TP53
SCHEMBL6442532 0.85 KMT2A (0.62) MEN1KMT2AMAPTIDH1MAPK1
SCHEMBL7824229 0.85 KMT2A (0.68) MEN1KMT2AMAPTIDH1MAPK1
SCHEMBL10221504 0.84 MEN1 (0.67) MEN1KMT2AMAPTIDH1MAPK1
SCHEMBL6442535 0.82 GAA (0.67) MEN1KMT2AMAPTGAAPOLB
SCHEMBL23485744 0.82 KMT2A (0.64) MEN1KMT2AMAPTIDH1MAPK1
SCHEMBL13556615 0.81 MAPT (0.60) MEN1KMT2AMAPTMAPK1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1148048-B1 Polyaromatic compounds for treating herpes viral infections PHARMACIA & UPJOHN CO LLC (US) 2005-06-29 EP claimed
EP-1148048-A2 Polyaromatic antiviral compositions PHARMACIA & UPJOHN COMPANY (US) 2001-10-24 EP claimed
US-6147116-A TOPICALLY ADMINISTERING BENZENE DERIVATIVE SUBSTITUTED WITH UREIDO-, THIOUREIDO, AND/OR SULFONAMIDO GROUPS TO TREAT HERPES PHARMACIA & UPJOHN COMPANY (US) 2000-11-14 US claimed
EP-1148048-B1 Polyaromatic compounds for treating herpes viral infections PHARMACIA & UPJOHN CO LLC (US) 2005-06-29 EP disclosed
EP-1148048-A2 Polyaromatic antiviral compositions PHARMACIA & UPJOHN COMPANY (US) 2001-10-24 EP disclosed
US-6147116-A TOPICALLY ADMINISTERING BENZENE DERIVATIVE SUBSTITUTED WITH UREIDO-, THIOUREIDO, AND/OR SULFONAMIDO GROUPS TO TREAT HERPES PHARMACIA & UPJOHN COMPANY (US) 2000-11-14 US disclosed
US-5958983-A NOVEL COMPOUNDS HAVING ANTIVIRAL ACTIVITY AGAINST HERPES, TOPICAL ADMINISTRATION THEM TO TREAT PATIENTS WITH HERPES; WORK BY INHIBITING THE INITIATION OF HERPES VIRAL DNA SYNTHESIS IN HOST CELLS PHARMACIA & UPJOHN COMPANY (US) 1999-09-28 US disclosed