SCHEMBL5486574

SCHEMBL5486574

Cc1cc(C#N)ccc1-c1ccc(-c2ccc(C#N)cn2)o1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 6/20 0.42
KCNH2 Q12809 1/20 0.42
CYP11B2 P19099 5/20 0.41
CYP11B1 P15538 4/20 0.41
ESR1 P03372 1/20 0.41
OXTR P30559 2/20 0.38
SLC22A12 Q96S37 1/20 0.38
AVPR1A P37288 1/20 0.38
GRM5 P41594 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL5493470 0.83 EGLN2 (0.45) EGLN2KCNH2GRM5KDM4EALDH1A1
SCHEMBL13185348 0.82 KDM4E (0.44) EGLN2KCNH2GRM5KDM4EALDH1A1
SCHEMBL5487740 0.76 GRM5 (0.45) EGLN2KCNH2CYP11B2CYP11B1GRM5
SCHEMBL4187933 0.76 GRM5 (0.49) EGLN2KCNH2CYP11B1GRM5
SCHEMBL3505152 0.75 GRM5 (0.41) EGLN2KCNH2GRM5KDM4EALDH1A1
SCHEMBL3503836 0.74 KDM4E (0.39) EGLN2KCNH2GRM5KDM4EALDH1A1
SCHEMBL14046725 0.74 KDM4E (0.39) EGLN2KCNH2GRM5KDM4EALDH1A1
SCHEMBL5487833 0.73 GRM5 (0.40) EGLN2KCNH2GRM5KDM4EALDH1A1
SCHEMBL14046723 0.73 EGLN2 (0.40) EGLN2KCNH2GRM5KDM4EALDH1A1
SCHEMBL17630069 0.72 CYP11B2 (0.44) EGLN2KCNH2CYP11B2CYP11B1OXTR

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
US-7256203-B2 Dicationic 2,5-diarylfuran aza-analogs as anti-protozoan agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2007-08-14 US disclosed
US-7256203-B2 Dicationic 2,5-diarylfuran aza-analogs as anti-protozoan agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2007-08-14 US disclosed
EP-1565458-A2 DICATIONIC 2,5-DIARYLFURAN AZA-ANALOGS AS ANTI-PROTOZOAN AGENTS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2005-08-24 EP disclosed
US-20040122015-A1 Dicationic 2,5-diarylfuran aza-analogs as anti-protozoan agents BOYKIN DAVID W (US) 2004-06-24 US disclosed
WO-2004050018-A2 DICATIONIC 2,5-DIARYLFURAN AZA-ANALOGS AS ANTI-PROTOZOAN AGENTS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2004-06-17 WO 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 (1 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-20040122015-A1 Dicationic 2,5-diarylfuran aza-analogs as anti-protozoan agents NR0B1, NR2C2, DECR1 EGLN2 1489/4885KCNH2 1516/4885CYP11B2 697/4885

“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.