SCHEMBL15919481

SCHEMBL15919481

COC(=O)C(COc1ccc(C#Cc2ccc(-c3cc(C(=O)NNC(=O)OC(C)(C)C)c4cnccc4n3)cc2)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TACR3 P29371 12/20 0.40
▸ ACACB O00763 2/20 0.40
▸ ACACA Q13085 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ TACR2 P21452 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ NFKB1 P19838 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ MTOR P42345 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ PMP22 Q01453 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ RAB9A P51151 4/20 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
SCHEMBL15919479 0.94 RAB9A (0.41) ACACBACACAKDM4EKMT2AALDH1A1
SCHEMBL15919549 0.87 ACACB (0.42) TACR3ACACBACACAKDM4EKMT2A
SCHEMBL15919476 0.84 ACACB (0.37) TACR3ACACBACACAKMT2AMEN1
SCHEMBL15919548 0.82 ACACB (0.43) ACACBACACAKDM4EKMT2AALDH1A1
SCHEMBL17323691 0.82 ACACB (0.35) TACR3ACACBACACAKDM4EKMT2A
SCHEMBL15919517 0.81 ACACB (0.44) ACACBACACAKDM4EKMT2AALDH1A1
SCHEMBL15919518 0.81 KMT2A (0.46) ACACBACACAKDM4EKMT2AALDH1A1
SCHEMBL15904908 0.80 ACACB (0.46) ACACBACACAKDM4EKMT2AALDH1A1
SCHEMBL15919475 0.79 EGLN2 (0.38) ACACBACACAKDM4EKMT2AALDH1A1
SCHEMBL15919281 0.79 ACACB (0.41) ACACBACACAKDM4EKMT2AALDH1A1

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 TACR3 2024/4885ACACB 1141/4885ACACA 1262/4885

“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.

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