SCHEMBL6751607

SCHEMBL6751607

c1ccc(-c2coc(-c3ccccc3C3=NCCCN3)c2)c(C2=NCCCN2)c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NISCH Q9Y2I1 10/20 0.51
▸ GAA P10253 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ TOP2A P11388 4/20 0.46
▸ TOP2B Q02880 4/20 0.46

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
SCHEMBL8539401 0.80 NISCH (0.66) NISCHGAATSHRTOP2ATOP2B
SCHEMBL5307832 0.79 TOP2A (0.61) NISCHGAATSHRTOP2ATOP2B
SCHEMBL6746742 0.79 NISCH (0.80) NISCHGAATSHRTOP2ATOP2B
SCHEMBL5441899 0.78 NISCH (0.59) NISCHGAATSHRTOP2ATOP2B
SCHEMBL8537356 0.76 NISCH (0.59) NISCHGAATSHRTOP2ATOP2B
SCHEMBL4298620 0.72 NISCH (0.58) NISCHGAATSHRTOP2ATOP2B
Formic Acid SCHEMBL4823088 0.71 NISCH (0.67) NISCHGAATSHRTOP2ATOP2B
SCHEMBL6751839 0.71 TOP2A (0.66) NISCHGAATSHRTOP2ATOP2B
SCHEMBL8536718 0.71 NISCH (0.64) NISCHGAATSHRTOP2ATOP2B
SCHEMBL11273702 0.69 NISCH (0.58) NISCHGAATSHRTOP2ATOP2B

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-1130019-B1 2,4-bis((4-Amidino)phenyl)furans as anti-pneumocystis carinii agents UNIV NORTH CAROLINA (US) 2004-05-06 — — EP disclosed
EP-0941991-B1 2,4-Bis (4-amidino)phenyl furans as anti-pneumocystis carinii agents UNIV NORTH CAROLINA (US) 2001-12-05 — — EP disclosed
EP-1130019-A1 2,4-bis((4-Amidino)phenyl)furans as anti-pneumocystis carinii agents UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2001-09-05 — — EP disclosed
US-6127554-A MAKING 2,4-BIS(HALO-PHENYL)FURAN COMPOUNDS BY REACTING 2,4-BIS(HALO-PHENYL),5-((HALO-PHENYL)CARBONYL)FURAN IN THE PRESENCE OF A BASE; CHEMICAL INTERMEDIATE TO SYNTHESIS OF ANTIMICROBIAL AGENT THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-10-03 — — US disclosed
US-6008247-A TREATING PNEUMONIA THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1999-12-28 — — US disclosed
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