SCHEMBL15919554

SCHEMBL15919554

O=C(O)c1cc(-c2ccc(Br)cc2)nc2cc(Cl)ncc12

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPRS1 P07814 4/20 0.60
DHODH Q02127 3/20 0.57
PTGES O14684 1/20 0.54
ALDH1A1 P00352 1/20 0.54
ALOX5 P09917 1/20 0.54
CYP2C9 P11712 1/20 0.54
HPGD P15428 1/20 0.54
CASP7 P55210 1/20 0.54
HIF1A Q16665 1/20 0.54
HSD17B10 Q99714 1/20 0.54

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
SCHEMBL15919601 0.85 EPRS1 (0.67) EPRS1DHODHALDH1A1HIF1AHSD17B10
SCHEMBL15919547 0.84 HIF1A (0.51) DHODHPTGESALDH1A1ALOX5CYP2C9
SCHEMBL31590457 0.82 PTGES (0.68) EPRS1DHODHPTGESALDH1A1ALOX5
SCHEMBL117422 0.80 PTGES (0.84) EPRS1DHODHPTGESALDH1A1ALOX5
SCHEMBL15905102 0.80 EPRS1 (0.64) EPRS1DHODHALDH1A1
SCHEMBL117430 0.79 EPRS1 (0.79) EPRS1DHODHPTGESALDH1A1ALOX5
SCHEMBL15919568 0.79 MAPT (0.43) EPRS1DHODHALDH1A1
SCHEMBL116022 0.78 DHODH (0.80) EPRS1DHODH
SCHEMBL29788463 0.78 DHODH (0.80) EPRS1DHODH
SCHEMBL18320549 0.77 DHODH (0.76) EPRS1DHODHPTGESALDH1A1ALOX5

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-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US disclosed
WO-2014117090-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2014-07-31 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-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO EPRS1 1402/4885DHODH 554/4885PTGES 735/4885

“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.