SCHEMBL19725934

SCHEMBL19725934

CC(C)(C)OC(=O)NC1CCCN(C#N)C1

nearest known ligand 0.84

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.84
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
BTK Q06187 2/20 0.51
JAK3 P52333 1/20 0.51
CTSL P07711 3/20 0.50
CTSB P07858 3/20 0.50
CTSH P09668 1/20 0.50
USP30 Q70CQ3 3/20 0.46
HSD11B1 P28845 2/20 0.44
CYP2C9 P11712 1/20 0.44
KCNA3 P22001 1/20 0.43
MAP4K4 O95819 2/20 0.43
GAA P10253 1/20 0.42
RET P07949 1/20 0.41
EPHX1 P07099 1/20 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
SCHEMBL14375421 0.92 CTSK (1.00) CTSKCA1CA2BTKJAK3
SCHEMBL14349368 0.92 CTSK (1.00) CTSKCA1CA2BTKJAK3
SCHEMBL14941684 0.87 CTSK (0.64) CTSKCA1CA2BTKJAK3
SCHEMBL458321 0.82 CTSK (0.83) CTSKCA1CA2BTKJAK3
SCHEMBL22199009 0.80 CA1 (0.60) CTSKCA1CA2BTKJAK3
SCHEMBL31045691 0.80 CTSK (0.73) CTSKCA1CA2BTKJAK3
SCHEMBL24476884 0.80 CA1 (0.63) CTSKCA1CA2BTKJAK3
SCHEMBL2729991 0.80 CA1 (0.63) CTSKCA1CA2BTKJAK3
SCHEMBL5007614 0.80 CA1 (0.63) CTSKCA1CA2BTKJAK3
SCHEMBL12440607 0.80 CA1 (0.63) CTSKCA1CA2BTKJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170360794-A1 JAK INHIBITOR Wuxi Fortune Pharmaceutical Co., Ltd (CN) 2017-12-21 US disclosed
US-20170360794-A1 JAK INHIBITOR Wuxi Fortune Pharmaceutical Co., Ltd (CN) 2017-12-21 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 (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-20170360794-A1 JAK INHIBITOR JAK2, JAK1, JAK3 CTSK 2424/4885CA1 4783/4885CA2 3472/4885

“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.