SCHEMBL17037459

SCHEMBL17037459

CC(C)[C@@]1(O)CC[C@H](C(N)=O)C(C)(C)C1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 0.34
EPHX1 P07099 1/20 0.31
SYK P43405 1/20 0.31

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
SCHEMBL12194584 1.00 SLC1A2 (0.34) SLC1A2SLC1A1EPHX1SYK
SCHEMBL17037508 0.84 SLC1A2 (0.42) SLC1A2SLC1A1SYK
SCHEMBL17037509 0.84 PTGS1 (0.33) SLC1A2SLC1A1
SCHEMBL17322955 0.84 PTGS1 (0.33) SLC1A2SLC1A1
SCHEMBL17037505 0.84 SLC1A2 (0.42) SLC1A2SLC1A1SYK
SCHEMBL17037507 0.84 SLC1A2 (0.42) SLC1A2SLC1A1SYK
SCHEMBL17037506 0.84 PTGS1 (0.33) SLC1A2SLC1A1
SCHEMBL16000457 0.84 SLC1A2 (0.42) SLC1A2SLC1A1SYK
SCHEMBL16000450 0.80 ATM (0.38) SYK
SCHEMBL17037510 0.80 ATM (0.38) SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9745295-B2 Thiazole-substituted aminoheteroaryls as spleen tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-08-29 US disclosed
US-9745295-B2 Thiazole-substituted aminoheteroaryls as spleen tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-08-29 US disclosed
US-9586931-B2 Triazolyl derivatives as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2017-03-07 US disclosed
US-20160060255-A1 THIAZOLE-SUBSTITUTED AMINOHETEROARYLS AS SPLEEN TYROSINE KINASE INHIBITORS MERCK CANADA INC. (CA) 2016-03-03 US disclosed
US-20150239866-A1 TRIAZOLYL DERIVATIVES AS SYK INHIBITORS MERCK CANADA INC. (CA) 2015-08-27 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-20150239866-A1 TRIAZOLYL DERIVATIVES AS SYK INHIBITORS SYK, BTK, TYRO3 SLC1A2 4870/4885SLC1A1 4795/4885EPHX1 2569/4885
US-20160060255-A1 THIAZOLE-SUBSTITUTED AMINOHETEROARYLS AS SPLEEN TYROSINE KINASE INHIBITORS SYK, TYRO3, BTK SLC1A2 2962/4885SLC1A1 1946/4885EPHX1 1529/4885

“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.