SCHEMBL2798709

SCHEMBL2798709

Cc1ccc(C(CNC(=O)OC(C)(C)C)C(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
SYK P43405 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.42
CTSS P25774 2/20 0.40
CTSK P43235 2/20 0.40
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
AAK1 Q2M2I8 1/20 0.39
SERPINE1 P05121 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.38
PTPN11 Q06124 1/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 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
SCHEMBL7269720 0.89 SYK (0.46) PPARASYKMEN1KMT2AGAA
SCHEMBL266021 0.88 CTSK (0.51) PPARGPPARASYKMEN1KMT2A
SCHEMBL118384 0.88 CTSK (0.51) PPARGPPARASYKMEN1KMT2A
SCHEMBL266022 0.88 CTSK (0.51) PPARGPPARASYKMEN1KMT2A
SCHEMBL23564593 0.87 GAA (0.46) PPARGPPARASYKMEN1KMT2A
SCHEMBL14975665 0.87 AAK1 (0.41) PPARGPPARASYKMEN1KMT2A
SCHEMBL192205 0.87 GAA (0.46) PPARGPPARASYKMEN1KMT2A
SCHEMBL2796410 0.87 L3MBTL1 (0.47) PPARGPPARASYKMEN1KMT2A
SCHEMBL30771337 0.87 AAK1 (0.48) SYKMEN1KMT2AGAASMN1; SMN2
SCHEMBL25045524 0.87 CTSS (0.46) SYKMEN1KMT2AGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160152576-A9 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2016-06-02 US disclosed
US-20140148436-A1 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2014-05-29 US disclosed
US-8680114-B2 AKT protein kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2014-03-25 US disclosed
US-20100168123-A1 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. 2010-07-01 US disclosed
EP-1684694-A2 AKT PROTEIN KINASE INHIBITORS Array Biopharma, Inc. (US) 2006-08-02 EP disclosed
US-20050130954-A1 Serine/threonine protein kinase inhibitors; hyperproliferative disorder or inflammatory conditions; e.g. 4-(4-(2-amino-3-(p-chlorophenyl)-propionyl)-piperazin-1-yl)-quinazoline ARRAY BIOPHARMA INC. 2005-06-16 US disclosed
WO-2005051304-A2 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2005-06-09 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 (4 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-20100168123-A1 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 PPARG 3267/4885PPARA 3032/4885SYK 832/4885
US-20140148436-A1 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 PPARG 3267/4885PPARA 3032/4885SYK 832/4885
US-20160152576-A9 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 PPARG 3267/4885PPARA 3032/4885SYK 832/4885
US-20050130954-A1 Serine/threonine protein kinase inhibitors; hyperproliferative disorder or inflammatory conditions; e.g. 4-(4-(2-amino-3-(p-chlorophenyl)-propionyl)-piperazin-1-yl)-quinazoline MTOR, CDK2, CLK2 PPARG 2285/4885PPARA 2268/4885SYK 760/4885

“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.