SCHEMBL6363591

SCHEMBL6363591

c1cc2[nH]c3ccc(C4=NCCN4)cc3c2cc1C1=NCCN1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 12/20 0.59
PRMT1 Q99873 1/20 0.55
LMNA P02545 1/20 0.51
RECQL P46063 1/20 0.51
TOP2A P11388 1/20 0.50
TOP2B Q02880 1/20 0.50

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
Hydrochloric Acid SCHEMBL6363441 0.98 NISCH (0.58) NISCHPRMT1LMNARECQLTOP2A
SCHEMBL6363258 0.86 PRMT1 (0.59) NISCHPRMT1LMNARECQL
Hydrochloric Acid SCHEMBL6362869 0.84 PRMT1 (0.57) NISCHPRMT1LMNARECQLTOP2A
SCHEMBL548346 0.81 NISCH (0.54) NISCHPRMT1
Hydrochloric Acid SCHEMBL7050789 0.79 LMNA (0.53) NISCHPRMT1LMNARECQLTOP2A
SCHEMBL5476725 0.78 NISCH (0.79) NISCHLMNARECQLTOP2ATOP2B
SCHEMBL549207 0.77 TOP2A (0.57) NISCHPRMT1TOP2ATOP2B
SCHEMBL13135587 0.77 NISCH (0.86) NISCHPRMT1LMNARECQL
Hydrochloric Acid SCHEMBL7761917 0.76 TOP2A (0.58) NISCHPRMT1LMNARECQLTOP2A
SCHEMBL14599548 0.76 PRMT1 (0.49) NISCHPRMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0831813-B1 METHODS OF INHIBITING PNEUMOCYSTIS CARINII PNEUMONIA AND COMPOUNDS USEFUL THEREFOR UNIV NORTH CAROLINA (US) 2005-01-19 EP claimed
EP-0831811-B1 CARBAZOLES FOR TREATING MICROBIAL INFECTIONS UNIV NORTH CAROLINA (US) 2003-11-19 EP claimed
EP-1105381-A1 DICATIONIC DIBENZOFURAN AND DIBENZOTHIOPHENE COMPOUNDS AND METHODS OF USE THEREOF The University of North Carolina at Chapel Hill (US) 2001-06-13 EP disclosed
US-6172104-B1 ADMINISTERING TO TREAT PNEUMOCYSTIS CARINII PNEUMONIA THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2001-01-09 US disclosed
WO-2000010990-A2 DICATIONIC DIBENZOFURAN AND DIBENZOTHIOPHENE COMPOUNDS AND METHODS OF USE THEREOF UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-03-02 WO disclosed