SCHEMBL25872149

SCHEMBL25872149

CC(C)N1C[C@H](F)[C@H](NC(=O)OC(C)(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.39
USP30 Q70CQ3 1/20 0.39
NFKB1 P19838 4/20 0.36
NFKB2 Q00653 4/20 0.36
RELA Q04206 4/20 0.36
HRH3 Q9Y5N1 1/20 0.36
KDM1A O60341 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
BTK Q06187 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.33
HSD11B1 P28845 1/20 0.33
DRD4 P21917 1/20 0.33
PREP P48147 1/20 0.33

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
SCHEMBL20626705 0.84 CTSK (0.40) CTSKNFKB1NFKB2RELAHRH3
SCHEMBL24928078 0.80 CTSK (0.41) CTSKUSP30NFKB1NFKB2RELA
SCHEMBL31368050 0.80 CTSK (0.41) CTSKUSP30NFKB1NFKB2RELA
SCHEMBL24928082 0.80 CTSK (0.41) CTSKUSP30NFKB1NFKB2RELA
SCHEMBL12026396 0.80 CTSK (0.50) CTSKNFKB1NFKB2RELAHRH3
SCHEMBL23260090 0.79 CTSK (0.40) CTSKUSP30NFKB1NFKB2RELA
SCHEMBL18484241 0.78 CTSK (0.42) CTSKNFKB1NFKB2RELAHRH3
SCHEMBL20147316 0.78 CTSK (0.44) CTSKNFKB1NFKB2RELAHRH3
SCHEMBL24033724 0.78 USP30 (0.59) CTSKUSP30CA1CA2BTK
SCHEMBL3827427 0.78 USP30 (0.50) CTSKUSP30NFKB1NFKB2RELA

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-11731987-B2 Prolyl hydroxylase domain-containing protein (PHD) inhibitors and uses thereof INSILICO MEDICINE IP LIMITED (HK) 2023-08-22 US disclosed
US-11731987-B2 Prolyl hydroxylase domain-containing protein (PHD) inhibitors and uses thereof INSILICO MEDICINE IP LIMITED (HK) 2023-08-22 US disclosed
US-20230192688-A1 PROLYL HYDROXYLASE DOMAIN-CONTAINING PROTEIN (PHD) INHIBITORS AND USES THEREOF INSILICO MEDICINE IP LIMITED (HK) 2023-06-22 US disclosed
US-20230192688-A1 PROLYL HYDROXYLASE DOMAIN-CONTAINING PROTEIN (PHD) INHIBITORS AND USES THEREOF INSILICO MEDICINE IP LIMITED (HK) 2023-06-22 US disclosed
WO-2023072257-A1 PROLYL HYDROXYLASE DOMAIN-CONTAINING PROTEIN (PHD) INHIBITORS AND USES THEREOF INSILICO MEDICINE IP LIMITED (CN) 2023-05-04 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-20230192688-A1 PROLYL HYDROXYLASE DOMAIN-CONTAINING PROTEIN (PHD) INHIBITORS AND USES THEREOF EGLN3, EGLN2, EGLN1 CTSK 2996/4885USP30 114/4885NFKB1 777/4885
US-11731987-B2 Prolyl hydroxylase domain-containing protein (PHD) inhibitors and uses thereof EGLN3, EGLN2, EGLN1 CTSK 2996/4885USP30 114/4885NFKB1 777/4885

“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.