SCHEMBL20063734

SCHEMBL20063734

CC(C)(C)OC(=O)N1CC(N[C@H]2CCCC[C@@H]2O)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.48
NR1H2 P55055 1/20 0.41
HPGD P15428 1/20 0.40
PDE4B Q07343 5/20 0.39
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
USP30 Q70CQ3 1/20 0.38
NPC1 O15118 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL1134425 0.87 EPHX1 (0.60) EPHX1HPGDALDH1A1MAPTNPC1
SCHEMBL8006120 0.87 EPHX1 (0.60) EPHX1HPGDALDH1A1MAPTNPC1
SCHEMBL3409077 0.87 EPHX1 (0.60) EPHX1HPGDALDH1A1MAPTNPC1
SCHEMBL13697320 0.84 EPHX1 (0.57) EPHX1HPGDALDH1A1MAPTNPC1
SCHEMBL20095669 0.82 EPHX1 (0.60) EPHX1NR1H2HPGDALDH1A1MAPT
SCHEMBL13697342 0.81 EPHX1 (0.48) EPHX1HPGDPDE4BALDH1A1MAPT
SCHEMBL34475148 0.80 EPHX1 (0.54) EPHX1NR1H2HPGDALDH1A1MAPT
SCHEMBL19701814 0.80 EPHX1 (0.49) EPHX1NR1H2HPGDCHRM2CHRM1
SCHEMBL16945092 0.80 EPHX1 (0.58) EPHX1HPGDPDE4BALDH1A1MAPT
SCHEMBL24033337 0.79 EPHX1 (0.43) EPHX1NR1H2HPGDPDE4BCHRM2

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-20200115354-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-04-16 US disclosed
US-10457654-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2019-10-29 US disclosed
WO-2018072602-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-26 WO disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 US disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 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 (3 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-20200115354-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF NPY5R, REN, F12 EPHX1 262/4885NR1H2 407/4885HPGD 899/4885
US-10457654-B2 Therapeutic compounds and methods of use thereof NPY5R, REN, F12 EPHX1 262/4885NR1H2 407/4885HPGD 899/4885
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF NPY5R, REN, F12 EPHX1 277/4885NR1H2 420/4885HPGD 892/4885

“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.