SCHEMBL15919488

SCHEMBL15919488

COc1cc(-c2cc(C(=O)NNC(=O)OC(C)(C)C)c3cnccc3n2)ccc1Br

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.43
KMT2A Q03164 9/20 0.43
MAPT P10636 5/20 0.42
KDM4E B2RXH2 5/20 0.42
ACACB O00763 1/20 0.42
ACACA Q13085 1/20 0.42
DHODH Q02127 1/20 0.41
ALDH1A1 P00352 6/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
LMNA P02545 2/20 0.40
PTPN7 P35236 1/20 0.40
DUSP3 P51452 1/20 0.40
POLB P06746 2/20 0.40
CYP3A4 P08684 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 2/20 0.40

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
SCHEMBL15919376 0.89 ACACB (0.43) MEN1KMT2AMAPTKDM4EACACB
SCHEMBL15905078 0.88 MEN1 (0.51) MEN1KMT2AMAPTKDM4EACACB
SCHEMBL15919491 0.87 KDM4E (0.41) MEN1KMT2AMAPTKDM4EACACB
SCHEMBL15919484 0.85 ACACB (0.39) MEN1KMT2AMAPTKDM4EACACB
SCHEMBL15919508 0.83 ACACB (0.48) MEN1KMT2AMAPTKDM4EACACB
SCHEMBL15919487 0.83 DHODH (0.53) MEN1KMT2AMAPTKDM4EDHODH
SCHEMBL15904908 0.81 ACACB (0.46) MEN1KMT2AMAPTKDM4EACACB
SCHEMBL15919510 0.81 ACACB (0.50) MEN1KMT2AMAPTKDM4EACACB
SCHEMBL15919373 0.80 ACACB (0.42) MEN1KMT2AMAPTKDM4EACACB
SCHEMBL15919262 0.80 ACACB (0.46) MEN1KMT2AMAPTKDM4EACACB

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 MEN1 511/4885KMT2A 1886/4885MAPT 2507/4885

“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.