SCHEMBL249487

SCHEMBL249487

CCOC(=O)C(C)(C)c1ccc(Cl)nn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.46
ABCB11 O95342 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
HTR2A P28223 1/20 0.44
PMP22 Q01453 1/20 0.44
PPARA Q07869 1/20 0.44
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
THRB P10828 1/20 0.38
RORC P51449 1/20 0.38
OPRK1 P41145 1/20 0.38
KDM4E B2RXH2 1/20 0.37
DGAT1 O75907 1/20 0.36
PIN1 Q13526 1/20 0.36
MAOB P27338 1/20 0.35
MMP8 P22894 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL245602 0.88 ABCB11 (0.44) CNR2ABCB11CYP1A2CYP3A4TSHR
SCHEMBL246875 0.83 TSHR (0.40) ABCB11CYP1A2CYP3A4TSHRHTR2A
SCHEMBL38656523 0.83 CNR2 (0.41) CNR2ABCB11CYP1A2CYP3A4TSHR
SCHEMBL31292247 0.82 LMNA (0.43) CNR2LMNAKMT2AKDM4EPOLB
SCHEMBL1549949 0.80 KMT2A (0.38) ABCB11CYP1A2CYP3A4TSHRHTR2A
SCHEMBL247624 0.79 KMT2A (0.46) CNR2ABCB11CYP1A2CYP3A4TSHR
SCHEMBL30628250 0.79 KMT2A (0.46) CNR2ABCB11CYP1A2CYP3A4TSHR
SCHEMBL31292268 0.78 CNR2 (0.38) CNR2ABCB11CYP1A2CYP3A4TSHR
SCHEMBL17796511 0.77 DGAT1 (0.49) CNR2ABCB11CYP1A2CYP3A4TSHR
SCHEMBL1718131 0.77 CYP3A4 (0.47) CNR2ABCB11CYP1A2CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102124005-B Cmet inhibitors TAKEDA PHARMACEUTICAL 2014-06-04 CN disclosed
US-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-11-28 US disclosed
EP-2588107-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET Takeda Pharmaceutical Company Limited (JP) 2013-05-08 EP disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
WO-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed
WO-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed
CN-102124005-A Cmet inhibitors TAKEDA PHARMACEUTICAL 2011-07-13 CN disclosed
EP-2313407-A1 cMET INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2011-04-27 EP disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
WO-2010019899-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
WO-2010019899-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET HGF, MET, HGFAC CNR2 3443/4885ABCB11 3677/4885CYP1A2 4767/4885
US-20100063054-A1 cMET INHIBITORS CEPT1, LCAT, GNMT CNR2 1933/4885ABCB11 271/4885CYP1A2 1101/4885

“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.