SCHEMBL3473488

SCHEMBL3473488

COC(=O)c1cccc(C(C)NC(=O)OC(C)(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.45
CASR P41180 1/20 0.43
KDM4D Q6B0I6 1/20 0.43
GABRB1 P18505 1/20 0.42
GABRB2 P47870 1/20 0.42
CTSS P25774 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
GPR139 Q6DWJ6 3/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40

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
SCHEMBL15609314 1.00 CTSK (0.45) CTSKCASRKDM4DGABRB1GABRB2
SCHEMBL505937 0.88 CTSK (0.48) CTSKGABRB1GABRB2CTSSGPR139
SCHEMBL320557 0.88 CTSK (0.48) CTSKGABRB1GABRB2CTSSGPR139
SCHEMBL30458165 0.87 NPSR1 (0.47) CTSKCYP4F2CYP4A11
SCHEMBL4841362 0.83 ROCK2 (0.45) CTSKCASRKDM4DGABRB1GABRB2
SCHEMBL4841357 0.83 ROCK2 (0.45) CTSKCASRKDM4DGABRB1GABRB2
SCHEMBL10070329 0.83 CASR (0.44) CTSKCASRKDM4DGABRB1GABRB2
SCHEMBL1725645 0.83 CTSK (0.45) CTSK
SCHEMBL3982091 0.83 CTSK (0.45) CTSK
SCHEMBL1269661 0.83 CTSK (0.45) CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2848610-B1 Inhibitors of kinase activity YM BIOSCIENCES AUSTRALIA PTY (AU) 2017-10-11 EP disclosed
EP-3048099-A2 INHIBITORS OF KINASE ACTIVITY YM BioSciences Australia Pty Ltd (AU) 2016-07-27 EP disclosed
US-9029386-B2 Pyridine derivatives useful as kinase inhibitors GILEAD SCIENCES, INC. (US) 2015-05-12 US disclosed
EP-2848610-A1 Inhibitors of kinase activity YM BioSciences Australia Pty Ltd (AU) 2015-03-18 EP disclosed
US-8461161-B2 Substituted pyrazines as inhibitors of kinase activity YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2013-06-11 US disclosed
US-20130137660-A1 INHIBITORS OF KINASE ACTIVITY YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2013-05-30 US disclosed
US-20100130447-A1 INHIBITORS OF KINASE ACTIVITY YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2010-05-27 US disclosed
EP-2099774-A1 INHIBITORS OF KINASE ACTIVITY Cytopia Research Pty Ltd (AU) 2009-09-16 EP disclosed
WO-2008058341-A1 INHIBITORS OF KINASE ACTIVITY CYTOPIA RESEARCH PTY LTD (AU) 2008-05-22 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 (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-20130137660-A1 INHIBITORS OF KINASE ACTIVITY FRK, LCK, FLT3 CTSK 472/4885CASR 1221/4885KDM4D 1708/4885
US-20100130447-A1 INHIBITORS OF KINASE ACTIVITY FRK, LCK, FLT3 CTSK 472/4885CASR 1221/4885KDM4D 1708/4885

“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.