SCHEMBL15919256

SCHEMBL15919256

COC(=O)c1cc(-c2ccc(-c3ccc(OCCNC(=O)OC(C)(C)C)cc3)cc2)nc2ccncc12

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 7/20 0.53
ACACB O00763 3/20 0.46
ACACA Q13085 2/20 0.46
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
SUCNR1 Q9BXA5 4/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PDE10A Q9Y233 1/20 0.42
LATS1 O95835 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL15919257 0.97 PLA2G2A (0.55) PLA2G2AACACBACACACA12CA1
SCHEMBL15919260 0.88 SUCNR1 (0.48) PLA2G2AACACBACACACA12CA1
SCHEMBL15919265 0.86 PLA2G2A (0.55) PLA2G2AKDM4EALDH1A1SMN1; SMN2PDE10A
SCHEMBL17323663 0.85 PLA2G2A (0.59) PLA2G2AKDM4EALDH1A1SMN1; SMN2PDE10A
SCHEMBL15919255 0.83 PLA2G2A (0.60) PLA2G2AKDM4EALDH1A1SMN1; SMN2PDE10A
SCHEMBL17327507 0.83 PLA2G2A (0.56) PLA2G2AKDM4EALDH1A1SMN1; SMN2PDE10A
Hydrochloric Acid SCHEMBL17313806 0.82 PLA2G2A (0.59) PLA2G2AKDM4EALDH1A1SMN1; SMN2PDE10A
SCHEMBL15904842 0.82 PLA2G2A (0.62) PLA2G2AKDM4EALDH1A1SMN1; SMN2PDE10A
SCHEMBL17323662 0.82 PLA2G2A (0.57) PLA2G2AKDM4EALDH1A1SMN1; SMN2PDE10A
SCHEMBL15919267 0.82 ACACB (0.45) PLA2G2AACACBACACAKDM4EALDH1A1

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 PLA2G2A 1990/4885ACACB 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.