SCHEMBL14950633

SCHEMBL14950633

CCO[C@@H](Cn1c(=O)n(C(C)(C)C(=O)CC(C)(C)[Si](O)(c2ccccc2)c2ccccc2)c(=O)c2c(C)c(Br)sc21)c1ccccc1OC

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 9/20 0.57
ACACA Q13085 16/20 0.46

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
SCHEMBL14950695 0.91 ACACB (0.54) ACACBACACA
SCHEMBL14948715 0.88 ACACB (0.65) ACACBACACA
SCHEMBL16922853 0.88 ACACB (0.67) ACACBACACA
SCHEMBL14948678 0.88 ACACB (0.68) ACACBACACA
SCHEMBL14948706 0.87 ACACB (0.79) ACACBACACA
SCHEMBL14950631 0.86 ACACA (0.62) ACACBACACA
SCHEMBL14945384 0.85 ACACB (0.58) ACACBACACA
SCHEMBL14950556 0.85 ACACB (0.45) ACACBACACA
SCHEMBL14948731 0.84 ACACB (0.71) ACACBACACA
SCHEMBL18909872 0.83 ACACA (0.46) ACACBACACA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160297834-A1 ACC INHIBITORS AND USES THEREOF GILEAD APOLLO, LLC 2016-10-13 US disclosed
US-20150203510-A1 ACC INHIBITORS AND USES THEREOF GILEAD APOLLO, LLC 2015-07-23 US disclosed
WO-2013071169-A1 ACC INHIBITORS AND USES THEREOF Nimbus Apollo, Inc. (US) 2013-05-16 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 (2 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-20150203510-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 ACACB 2/4885ACACA 1/4885
US-20160297834-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 ACACB 2/4885ACACA 1/4885

“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.