SCHEMBL2225628

SCHEMBL2225628

COc1ccc2c(c1)OC1CN(C(=O)OC(C)(C)C)CCC21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
STS P08842 2/20 0.47
EPHX2 P34913 1/20 0.44
HTT P42858 2/20 0.44
GPR119 Q8TDV5 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
SRC P12931 2/20 0.43
ABL1 P00519 1/20 0.43
EGFR P00533 1/20 0.43
ABL2 P42684 1/20 0.43
PDE4B Q07343 1/20 0.42
MMP1 P03956 2/20 0.42
MMP9 P14780 2/20 0.42
MMP3 P08254 1/20 0.42
MMP7 P09237 1/20 0.42
CTSD P07339 1/20 0.41
CTSE P14091 1/20 0.41
BACE1 P56817 1/20 0.41
TGFBR1 P36897 2/20 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
SCHEMBL12518515 0.87 GPR119 (0.48) EPHX2GPR119MEN1KMT2APDE4B
SCHEMBL2227314 0.87 ESR2 (0.45) GPR119KMT2ASRCABL1EGFR
SCHEMBL2227160 0.86 USP30 (0.41) ALDH1A1GPR119PDE4BKDM4EUSP30
SCHEMBL2226311 0.84 PTPN2 (0.44) ALDH1A1HTTGPR119ABL1USP30
SCHEMBL16551431 0.84 HTR6 (0.47) ALDH1A1STSGPR119MMP1MMP9
SCHEMBL2227245 0.83 GPR119 (0.47) STSGPR119KDM4EUSP30
SCHEMBL12517033 0.82 PDE4B (0.44) ALDH1A1STSMEN1KMT2APDE4B
SCHEMBL12518729 0.81 USP30 (0.53) GPR119PDE4BBACE1KDM4EUSP30
SCHEMBL12518728 0.81 OPRM1 (0.53) GPR119KMT2ASRCABL1EGFR
SCHEMBL25170898 0.80 HDAC1 (0.45) GPR119MEN1KMT2AUSP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516445-B1 TRICYCLIC DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS CEPHALON INC (US) 2015-03-11 EP disclosed
EP-2516445-B1 TRICYCLIC DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS CEPHALON INC (US) 2015-03-11 EP disclosed
US-8765779-B2 Tricyclic derivatives and their pharmaceutical use and compositions CEPHALON, INC. (US) 2014-07-01 US disclosed
US-8765779-B2 Tricyclic derivatives and their pharmaceutical use and compositions CEPHALON, INC. (US) 2014-07-01 US disclosed
US-8765779-B2 Tricyclic derivatives and their pharmaceutical use and compositions CEPHALON, INC. (US) 2014-07-01 US disclosed
US-20120295882-A1 Tricyclic Derivatives and Their Pharmaceutical Use and Compositions CEPHALON, INC. (US) 2012-11-22 US disclosed
US-20120295882-A1 Tricyclic Derivatives and Their Pharmaceutical Use and Compositions CEPHALON, INC. (US) 2012-11-22 US disclosed
US-20120295882-A1 Tricyclic Derivatives and Their Pharmaceutical Use and Compositions CEPHALON, INC. (US) 2012-11-22 US disclosed
EP-2516445-A2 TRICYCLIC DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS Cephalon, Inc. (US) 2012-10-31 EP disclosed
WO-2011087712-A2 TRICYCLIC DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS CEPHALON, INC. (US) 2011-07-21 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 (1 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-20120295882-A1 Tricyclic Derivatives and Their Pharmaceutical Use and Compositions CYP3A43, CYP3A7, CYP2C19 ALDH1A1 705/4885STS 248/4885EPHX2 570/4885

“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.