SCHEMBL1170892

SCHEMBL1170892

Cc1cccc2[nH]c(-c3nc4c(C)cccc4[nH]3)nc12

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MGAM O43451 16/20 0.71
GAA P10253 16/20 0.71
SI P14410 16/20 0.71
MGAM2 Q2M2H8 16/20 0.71
ESR1 P03372 1/20 0.67
CBFB Q13951 1/20 0.67
ADORA3 P0DMS8 1/20 0.61
ADORA2A P29274 1/20 0.61
ADORA1 P30542 1/20 0.61

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
SCHEMBL2578465 0.88 CBFB (0.73) MGAMGAASIMGAM2ESR1
SCHEMBL5074029 0.87 MGAM (0.76) MGAMGAASIMGAM2ESR1
SCHEMBL30615069 0.87 MGAM (0.76) MGAMGAASIMGAM2ESR1
SCHEMBL3140429 0.85 MGAM (0.59) MGAMGAASIMGAM2ESR1
SCHEMBL6056826 0.85 MGAM (0.77) MGAMGAASIMGAM2ESR1
SCHEMBL5201195 0.84 MGAM (0.72) MGAMGAASIMGAM2ESR1
SCHEMBL15319142 0.84 ESR1 (0.59) MGAMGAASIMGAM2ESR1
SCHEMBL5201203 0.84 MGAM (1.00) MGAMGAASIMGAM2ESR1
SCHEMBL353891 0.83 PARP1 (0.56) MGAMGAASIMGAM2ESR1
SCHEMBL10695650 0.82 MGAM (1.00) MGAMGAASIMGAM2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140100245-A1 Antiviral Drugs for Treatment of Arenvirus Infection SIGA TECHNOLOGIES, INC. (US) 2014-04-10 US claimed
US-8623347-B2 Antiviral drugs for treatment of arenavirus infection SIGA TECHNOLOGIES, INC. (US) 2014-01-07 US claimed
US-20110027227-A1 ANTIVIRAL DRUGS FOR TREATMENT OF ARENAVIRUS INFECTION SIGA TECHNOLOGIES, INC. 2011-02-03 US claimed
US-20140100245-A1 Antiviral Drugs for Treatment of Arenvirus Infection SIGA TECHNOLOGIES, INC. (US) 2014-04-10 US disclosed
US-8623347-B2 Antiviral drugs for treatment of arenavirus infection SIGA TECHNOLOGIES, INC. (US) 2014-01-07 US disclosed
US-8623347-B2 Antiviral drugs for treatment of arenavirus infection SIGA TECHNOLOGIES, INC. (US) 2014-01-07 US disclosed
US-8623347-B2 Antiviral drugs for treatment of arenavirus infection SIGA TECHNOLOGIES, INC. (US) 2014-01-07 US disclosed
US-20110027227-A1 ANTIVIRAL DRUGS FOR TREATMENT OF ARENAVIRUS INFECTION SIGA TECHNOLOGIES, INC. 2011-02-03 US disclosed
US-20110027227-A1 ANTIVIRAL DRUGS FOR TREATMENT OF ARENAVIRUS INFECTION SIGA TECHNOLOGIES, INC. 2011-02-03 US disclosed
US-20110027227-A1 ANTIVIRAL DRUGS FOR TREATMENT OF ARENAVIRUS INFECTION SIGA TECHNOLOGIES, INC. 2011-02-03 US disclosed
WO-2009123776-A2 ANTIVIRAL DRUGS FOR TREATMENT OF ARENAVIRUS INFECTION SIGA TECHNOLOGIES, INC. (US) 2009-10-08 WO disclosed
EP-0513966-B1 Bis-bibenzimidazole composition ZENECA LTD (GB) 1998-04-29 EP disclosed
US-5258524-A Solvent extraction of zinc IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-11-02 US disclosed
EP-0513966-A2 Bis-bibenzimidazole composition ZENECA LIMITED (GB) 1992-11-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140100245-A1 Antiviral Drugs for Treatment of Arenvirus Infection HAVCR2, ZC3HAV1, SARS1 MGAM 2818/4885GAA 46/4885SI 1758/4885
US-20110027227-A1 ANTIVIRAL DRUGS FOR TREATMENT OF ARENAVIRUS INFECTION ZC3HAV1, EIF2AK2, SARS1 MGAM 1181/4885GAA 26/4885SI 1218/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.