SCHEMBL7056984

SCHEMBL7056984

N=C(N)c1ccc2c(c1)oc1c(C(=N)N)cccc12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 4/20 0.44
▸ F2 P00734 3/20 0.44
▸ PLG P00747 2/20 0.44
▸ PRSS1 P07477 2/20 0.44
▸ PLAU P00749 2/20 0.44
▸ PLAT P00750 1/20 0.44
▸ KLK1 P06870 1/20 0.44
▸ PRSS2 P07478 1/20 0.41
▸ PRSS3 P35030 1/20 0.41
▸ F10 P00742 2/20 0.41
▸ HTR2B P41595 1/20 0.40
▸ TTR P02766 1/20 0.38

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
SCHEMBL22924252 0.82 ALOX5 (0.48) —
SCHEMBL12348359 0.80 PRMT1 (0.58) PRMT1F2PLGPRSS1PLAU
Hydrochloric Acid SCHEMBL7766605 0.78 PRMT1 (0.56) PRMT1F2PLGPRSS1PLAU
SCHEMBL11575253 0.71 TTR (0.45) HTR2BTTR
SCHEMBL3368604 0.69 MEN1 (0.55) F2PLGPRSS1PLAUPLAT
SCHEMBL21926432 0.69 ALOX5 (0.56) F2PLGPRSS1PLAUPLAT
Hydrochloric Acid SCHEMBL29213647 0.68 KMT2A (0.53) F2PLGPRSS1PLAUPLAT
Hydrochloric Acid SCHEMBL28919945 0.68 ALOX5 (0.56) PRMT1F2PLGPRSS1PLAU
SCHEMBL20793973 0.67 ALOX5 (0.45) HTR2B
SCHEMBL23627157 0.66 ALOX5 (0.39) F2PLGF10HTR2B

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-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 claimed
US-6172104-B1 ADMINISTERING TO TREAT PNEUMOCYSTIS CARINII PNEUMONIA THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2001-01-09 — — US claimed
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 claimed
EP-1105381-B1 DIBENZOTHIOPHENE COMPOUNDS AND METHODS OF USE THEREOF UNIV NORTH CAROLINA (US) 2003-05-02 — — EP disclosed
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
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