SCHEMBL10184205

SCHEMBL10184205

CC(C)(C)OC(=O)N1CC[C@H](c2cc(O)cc(-c3ccccc3)c2)[C@@H](C(=O)O)C1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 9/20 0.52
TACR1 P25103 1/20 0.50
PDE4B Q07343 1/20 0.45
GPR119 Q8TDV5 2/20 0.44
KAT7 O95251 1/20 0.44
KAT8 Q9H7Z6 1/20 0.44
EGFR P00533 2/20 0.43
SRC P12931 2/20 0.43
ABL1 P00519 1/20 0.43
ABL2 P42684 1/20 0.43
HPGDS O60760 1/20 0.42
JAK2 O60674 1/20 0.41
JAK1 P23458 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
SCHEMBL8263747 1.00 USP30 (0.52) USP30TACR1PDE4BGPR119KAT7
SCHEMBL8263768 0.91 PDE4B (0.50) USP30TACR1PDE4BKAT7KAT8
SCHEMBL13617897 0.89 TACR1 (0.55) USP30TACR1PDE4BGPR119EGFR
SCHEMBL2245296 0.89 TACR1 (0.55) USP30TACR1PDE4BGPR119EGFR
SCHEMBL12054657 0.89 TACR1 (0.55) USP30TACR1PDE4BGPR119EGFR
SCHEMBL8265031 0.89 TACR1 (0.55) USP30TACR1PDE4BGPR119EGFR
SCHEMBL2239759 0.89 TACR1 (0.55) USP30TACR1PDE4BGPR119EGFR
SCHEMBL8265154 0.88 USP30 (0.50) USP30TACR1PDE4BGPR119EGFR
SCHEMBL13617939 0.88 USP30 (0.50) USP30TACR1PDE4BGPR119EGFR
SCHEMBL3195548 0.87 USP30 (0.57) USP30TACR1PDE4BGPR119EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178559-B2 Organic compounds NOVARTIS AG (CH) 2012-05-15 US disclosed
US-8178559-B2 Organic compounds NOVARTIS AG (CH) 2012-05-15 US disclosed
US-8084450-B2 Organic compounds NOVARTIS AG (CH) 2011-12-27 US disclosed
US-8084450-B2 Organic compounds NOVARTIS AG (CH) 2011-12-27 US disclosed
US-20110263560-A1 Organic Compounds NOVARTIS AG (CH) 2011-10-27 US disclosed
US-20110263560-A1 Organic Compounds NOVARTIS AG (CH) 2011-10-27 US disclosed
US-20090312304-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-17 US disclosed
US-20090312304-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-17 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-20110263560-A1 Organic Compounds REN, ACE, OTC USP30 3528/4885TACR1 433/4885PDE4B 457/4885
US-20090312304-A1 ORGANIC COMPOUNDS REN, ACE, PIGO USP30 3470/4885TACR1 475/4885PDE4B 543/4885

“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.