SCHEMBL15919262

SCHEMBL15919262

CC(C)(C)OC(=O)NNC(=O)c1cc(-c2ccc(-c3ccc(-c4cc(C(=O)O)on4)cc3)cc2)nc2ccncc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACACB O00763 7/20 0.46
ACACA Q13085 5/20 0.46
USP30 Q70CQ3 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
DHODH Q02127 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
GAA P10253 1/20 0.38
DGAT2 Q96PD7 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
SCHEMBL15919419 0.88 ACACB (0.44) ACACBACACAMEN1KMT2AKDM4E
SCHEMBL15905078 0.87 MEN1 (0.51) ACACBACACAMEN1KMT2AKDM4E
SCHEMBL15919453 0.85 CYP1A2 (0.46) ACACBACACAMEN1KMT2ASMN1; SMN2
SCHEMBL15919270 0.85 ACACB (0.42) ACACBACACAMEN1KMT2AKDM4E
SCHEMBL15919473 0.84 DHODH (0.42) MEN1KMT2AKDM4EMAPTDHODH
SCHEMBL15919508 0.84 ACACB (0.48) ACACBACACAMEN1KMT2AKDM4E
SCHEMBL15919277 0.84 ACACB (0.41) ACACBACACAUSP30SMN1; SMN2CYP1A2
SCHEMBL15905347 0.82 MAPT (0.49) MEN1KMT2AKDM4ENPC1MAPT
SCHEMBL15904908 0.82 ACACB (0.46) ACACBACACAMEN1KMT2AKDM4E
SCHEMBL15919510 0.82 ACACB (0.50) ACACBACACAMEN1KMT2AKDM4E

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 1262/4885USP30 2236/4885

“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.