SCHEMBL19863558

SCHEMBL19863558

CC(C)(C)OC(=O)NC1CCN(S(=O)(=O)CC(F)(F)F)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.52
CTSK P43235 2/20 0.47
CYP2C9 P11712 1/20 0.43
HSD11B1 P28845 1/20 0.43
TSHR P16473 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.43
CCR5 P51681 1/20 0.42
KCNA3 P22001 1/20 0.42
BRD4 O60885 2/20 0.41
NAMPT P43490 1/20 0.41
BTK Q06187 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
DRD2 P14416 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
SCHEMBL4637428 0.88 TSHR (0.55) EPHX2CTSKCYP2C9HSD11B1TSHR
SCHEMBL14417786 0.83 ALDH1A1 (0.54) EPHX2CTSKCYP2C9HSD11B1TSHR
SCHEMBL17557665 0.82 CTSK (0.50) EPHX2CTSKCYP2C9HSD11B1GAA
SCHEMBL31443321 0.82 CTSK (0.52) EPHX2CTSKCYP2C9HSD11B1GAA
SCHEMBL17557565 0.82 CTSK (0.47) CTSKCYP2C9HSD11B1TSHRL3MBTL1
SCHEMBL30761942 0.81 TSHR (0.48) EPHX2CTSKCYP2C9HSD11B1TSHR
SCHEMBL25123847 0.80 CTSK (0.54) EPHX2CTSKCYP2C9HSD11B1GAA
SCHEMBL17591811 0.80 CTSK (0.54) EPHX2CTSKCYP2C9HSD11B1L3MBTL1
SCHEMBL19857415 0.80 EPHX2 (0.58) EPHX2TSHRL3MBTL1GAA
SCHEMBL3841283 0.80 CTSK (0.54) EPHX2CTSKCYP2C9HSD11B1KCNA3

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
US-20220324872-A1 CDK2/4/6 Inhibitors PFIZER INC. (US) 2022-10-13 US disclosed
US-11396512-B2 CDK2/4/6 inhibitors PFIZER INC. (US) 2022-07-26 US disclosed
US-11396512-B2 CDK2/4/6 inhibitors PFIZER INC. (US) 2022-07-26 US disclosed
US-20200392142-A1 CDK2/4/6 Inhibitors PFIZER INC. (US) 2020-12-17 US disclosed
US-10800783-B2 CDK2/4/6 inhibitors PFIZER INC. (US) 2020-10-13 US disclosed
US-20190135817-A1 CDK2/4/6 Inhibitors PFIZER INC. (US) 2019-05-09 US disclosed
US-10233188-B2 CDK2/4/6 inhibitors PFIZER INC. (US) 2019-03-19 US disclosed
WO-2018033815-A1 PYRIDOPYRIMDINONE CDK2/4/6 INHIBITORS PFIZER INC. (US) 2018-02-22 WO disclosed
US-20180044344-A1 CDK2/4/6 Inhibitors PFIZER INC. (US) 2018-02-15 US disclosed
US-20180044344-A1 CDK2/4/6 Inhibitors PFIZER INC. (US) 2018-02-15 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 (7 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-20220324872-A1 CDK2/4/6 Inhibitors CDK2, CDK6, CDK20 EPHX2 3664/4885CTSK 3314/4885CYP2C9 1172/4885
US-20200392142-A1 CDK2/4/6 Inhibitors CDK2, CDK6, CDK20 EPHX2 3656/4885CTSK 3281/4885CYP2C9 1175/4885
US-11396512-B2 CDK2/4/6 inhibitors CDK2, CDK6, CDK20 EPHX2 3664/4885CTSK 3314/4885CYP2C9 1172/4885
US-10800783-B2 CDK2/4/6 inhibitors CDK2, CDK6, CDK20 EPHX2 3664/4885CTSK 3314/4885CYP2C9 1172/4885
US-20180044344-A1 CDK2/4/6 Inhibitors CDK2, CDK6, CDK20 EPHX2 3664/4885CTSK 3314/4885CYP2C9 1172/4885
US-20190135817-A1 CDK2/4/6 Inhibitors CDK2, CDK6, CDK20 EPHX2 3664/4885CTSK 3314/4885CYP2C9 1172/4885
US-10233188-B2 CDK2/4/6 inhibitors CDK2, CDK6, CDK20 EPHX2 3664/4885CTSK 3314/4885CYP2C9 1172/4885

“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.