SCHEMBL15919484

SCHEMBL15919484

COc1cc(-c2cc(C(=O)NNC(=O)OC(C)(C)C)c3cnccc3n2)ccc1C#C[Si](C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACACB O00763 2/20 0.39
ACACA Q13085 1/20 0.39
MAPT P10636 5/20 0.39
KDM4E B2RXH2 5/20 0.39
ALDH1A1 P00352 6/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
GAA P10253 3/20 0.38
LMNA P02545 2/20 0.38
DHODH Q02127 2/20 0.38
MEN1 O00255 7/20 0.38
KMT2A Q03164 7/20 0.38
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
POLB P06746 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
SCHEMBL15919378 0.90 ACACB (0.40) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15919491 0.89 KDM4E (0.41) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15919517 0.87 ACACB (0.44) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15919488 0.85 MEN1 (0.43) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15919373 0.81 ACACB (0.42) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15905078 0.80 MEN1 (0.51) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15919508 0.79 ACACB (0.48) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15919486 0.79 KMT2A (0.36) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15904908 0.79 ACACB (0.46) ACACBACACAMAPTKDM4EALDH1A1
SCHEMBL15919492 0.78 ROCK2 (0.38) ACACBACACAMAPTALDH1A1SMN1; SMN2

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 1262/4885MAPT 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.