SCHEMBL16798329

SCHEMBL16798329

CC(C)(C)OC(=O)NCC(Cc1ccc(F)cc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSS P25774 7/20 0.56
CTSK P43235 6/20 0.56
GAA P10253 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SYK P43405 1/20 0.44
ATM Q13315 1/20 0.43
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
EPHX2 P34913 2/20 0.41
PPARG P37231 2/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
GRM2 Q14416 1/20 0.41
POLB P06746 1/20 0.41
PTPRB P23467 1/20 0.41

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
SCHEMBL3825012 0.88 ATM (0.55) CTSSCTSKGAAMEN1KMT2A
SCHEMBL1186455 0.88 ATM (0.55) CTSSCTSKGAAMEN1KMT2A
SCHEMBL825959 0.88 ATM (0.55) CTSSCTSKGAAMEN1KMT2A
SCHEMBL2799300 0.87 GAA (0.50) CTSSCTSKGAAMEN1KMT2A
SCHEMBL3697318 0.87 CTSS (0.56) CTSSCTSKGAAMEN1KMT2A
SCHEMBL2799041 0.87 GAA (0.50) CTSSCTSKGAAMEN1KMT2A
SCHEMBL12101475 0.87 MEN1 (0.47) CTSSCTSKGAAMEN1KMT2A
SCHEMBL16798417 0.86 LDHA (0.52) GAAMEN1KMT2ASYKEPHX2
SCHEMBL30718545 0.84 CYP17A1 (0.47) CTSSCTSKGAAMEN1KMT2A
SCHEMBL2263968 0.83 GAA (0.41) CTSSCTSKGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11376260-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2022-07-05 US disclosed
US-20210106593-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2021-04-15 US disclosed
US-10842799-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2020-11-24 US disclosed
US-20200078371-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2020-03-12 US disclosed
US-20190192534-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2019-06-27 US disclosed
US-10278975-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2019-05-07 US disclosed
CN-106029672-B serine/threonine kinase inhibitors 基因泰克公司 2019-03-29 CN disclosed
EP-3077401-B1 SERINE/THREONINE KINASE INHIBITORS GENENTECH INC (US) 2018-04-18 EP disclosed
US-9867833-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2018-01-16 US disclosed
US-20180000833-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2018-01-04 US disclosed
EP-3077401-A1 SERINE/THREONINE KINASE INHIBITORS Genentech, Inc. (US) 2016-10-12 EP disclosed
CN-106029672-A Serine/threonine kinase inhibitors 基因泰克公司 2016-10-12 CN disclosed
US-20150182537-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2015-07-02 US disclosed
WO-2015085007-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2015-06-11 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 (8 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-11376260-B2 Serine/threonine kinase inhibitors MAP3K1, MAP3K4, MAP4K2 CTSS 4008/4885CTSK 2774/4885GAA 3060/4885
US-10842799-B2 Serine/threonine kinase inhibitors MAP3K1, MAP3K4, MAP4K2 CTSS 4008/4885CTSK 2774/4885GAA 3060/4885
US-20150182537-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K4, MAP4K2 CTSS 4008/4885CTSK 2774/4885GAA 3060/4885
US-20180000833-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K4, MAP4K2 CTSS 4008/4885CTSK 2774/4885GAA 3060/4885
US-10278975-B2 Serine/threonine kinase inhibitors MAP3K1, MAP3K4, MAP4K2 CTSS 4008/4885CTSK 2774/4885GAA 3060/4885
US-20190192534-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K4, MAP4K2 CTSS 4008/4885CTSK 2774/4885GAA 3060/4885
US-20210106593-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K4, MAP4K2 CTSS 4008/4885CTSK 2774/4885GAA 3060/4885
US-20200078371-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K4, MAP4K2 CTSS 4008/4885CTSK 2774/4885GAA 3060/4885

“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.