SCHEMBL19929953

SCHEMBL19929953

CC(C)(C)Oc1ccc(CC(C(=O)C(C)(C)C)N(CC(=O)C(C)(C)C)CC(=O)C(C)(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 4/20 0.43
▸ PPARA Q07869 3/20 0.35
▸ PPARG P37231 2/20 0.35
▸ ELANE P08246 1/20 0.34
▸ LDHA P00338 1/20 0.34
▸ PTPN1 P18031 1/20 0.34
▸ ABCB1 P08183 1/20 0.34
▸ CNR1 P21554 3/20 0.33
▸ CNR2 P34972 2/20 0.33
▸ CTSL P07711 1/20 0.33
▸ CTSK P43235 1/20 0.33
▸ NPY5R Q15761 2/20 0.32

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
SCHEMBL19929952 0.96 ACACB (0.40) ACACBPPARAPPARGELANELDHA
SCHEMBL21288120 0.93 ACACB (0.41) ACACBPPARAPPARGELANEPTPN1
SCHEMBL21288046 0.80 ESR1 (0.38) —
SCHEMBL21288164 0.79 CA2 (0.32) —
SCHEMBL20363264 0.76 ACACB (0.52) ACACBPPARAPPARGELANELDHA
SCHEMBL1703013 0.75 ACACB (0.48) ACACBPPARAPPARGELANELDHA
SCHEMBL20363241 0.73 ACACB (0.50) ACACBPPARAPPARGELANELDHA
SCHEMBL1709313 0.73 PPARG (0.48) ACACBPPARAPPARGELANELDHA
SCHEMBL24238523 0.68 KMT2A (0.33) —
SCHEMBL10785304 0.68 MMP13 (0.43) ACACBPPARAPPARGLDHAPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180064819-A1 Targeting Ligands SIXTH STREETLENDING PARTNERS, AS THE ADMINISTRATIVE AGENT 2018-03-08 — — US 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-20180064819-A1 Targeting Ligands FABP1, SNRPE, HAVCR2 ACACB 773/4885PPARA 1589/4885PPARG 1743/4885

“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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