SCHEMBL4294379

SCHEMBL4294379

COc1nc(N(C[C@@H](Cc2ccc(C(F)(F)F)cc2)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)sc1-c1ccc2cnccc2c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 8/20 0.41
CDK2 P24941 7/20 0.41
SGK1 O00141 1/20 0.40
ROCK2 O75116 1/20 0.34
PTPRB P23467 1/20 0.33
DGAT2 Q96PD7 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
CYP3A4 P08684 4/20 0.32
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
PPARD Q03181 1/20 0.32
FFAR2 O15552 1/20 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
SCHEMBL4294382 0.92 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL4294376 0.92 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL4291758 0.92 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL4291762 0.92 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL4291766 0.92 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL13893755 0.91 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL4301332 0.90 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL4301329 0.90 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL4301334 0.90 AKT1 (0.40) AKT1CDK2SGK1ROCK2PTPRB
SCHEMBL4298351 0.88 AKT1 (0.38) AKT1CDK2SGK1ROCK2PTPRB

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
EP-1981884-B1 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS AMGEN INC (US) 2012-06-13 EP disclosed
US-8084479-B2 Thiazole compounds and methods of use AMGEN INC. (US) 2011-12-27 US disclosed
US-20090270445-A1 Thiazole compounds and methods of use AMGEN INC. (US) 2009-10-29 US disclosed
US-7514566-B2 Thiazole compounds and methods of use AMGEN, INC. (US) 2009-04-07 US disclosed
EP-1981884-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS Amgen, Inc (US) 2008-10-22 EP disclosed
WO-2007084391-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B ( PKB) INHIBITORS AMGEN INC. (US) 2007-07-26 WO disclosed
US-20070173506-A1 Thiazole compounds and methods of use AMGEN INC. (US) 2007-07-26 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 (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-20090270445-A1 Thiazole compounds and methods of use MTOR, JAK2, TK2 AKT1 80/4885CDK2 11/4885SGK1 98/4885
US-20070173506-A1 Thiazole compounds and methods of use MTOR, JAK2, PCK2 AKT1 143/4885CDK2 62/4885SGK1 163/4885

“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.