SCHEMBL15919376

SCHEMBL15919376

CC(C)(C)OC(=O)NNC(=O)c1cc(-c2ccc(Br)c(F)c2)nc2ccncc12

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACACB O00763 5/20 0.43
ACACA Q13085 4/20 0.43
KMT2A Q03164 6/20 0.41
MEN1 O00255 5/20 0.41
GAA P10253 3/20 0.39
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 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
SCHEMBL15905078 0.89 MEN1 (0.51) ACACBACACAKMT2AMEN1GAA
SCHEMBL15919488 0.89 MEN1 (0.43) ACACBACACAKMT2AMEN1GAA
SCHEMBL15919373 0.86 ACACB (0.42) ACACBACACAKMT2AMEN1GAA
SCHEMBL15919508 0.85 ACACB (0.48) ACACBACACAKMT2AMEN1GAA
SCHEMBL15919378 0.84 ACACB (0.40) ACACBACACAKMT2AMEN1GAA
SCHEMBL15904908 0.82 ACACB (0.46) ACACBACACAKMT2AMEN1GAA
SCHEMBL15919510 0.82 ACACB (0.50) ACACBACACAKMT2AMEN1GAA
SCHEMBL15919262 0.81 ACACB (0.46) ACACBACACAKMT2AMEN1GAA
SCHEMBL15919374 0.81 ALDH1A1 (0.52) KMT2AMEN1GAAALDH1A1
SCHEMBL15919688 0.80 MCL1 (0.45) ACACBACACAKMT2AMEN1GAA

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 ACACB 1141/4885ACACA 1262/4885KMT2A 1886/4885

“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.