SCHEMBL35210538

SCHEMBL35210538

CC(C)(C)OC(=O)N1C[C@H](O)[C@H]1COCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.42
NR1H3 Q13133 2/20 0.42
KLK7 P49862 1/20 0.42
PARP1 P09874 1/20 0.42
AGTR2 P50052 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
STS P08842 1/20 0.39
TACR1 P25103 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PPARA Q07869 1/20 0.39
ABCB1 P08183 1/20 0.39
ABHD6 Q9BV23 2/20 0.38

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
SCHEMBL7301938 0.88 KLK7 (0.47) KLK7PARP1JAK2JAK1STS
SCHEMBL28549464 0.85 PARP1 (0.46) NR1H2NR1H3KLK7PARP1AGTR2
SCHEMBL14199452 0.83 KLK7 (0.47) NR1H2NR1H3KLK7PARP1AGTR2
SCHEMBL35210768 0.83 TACR1 (0.44) NR1H2NR1H3KLK7PARP1AGTR2
SCHEMBL35210684 0.82 TACR1 (0.46) NR1H2NR1H3KLK7PARP1AGTR2
SCHEMBL35211172 0.81 KLK7 (0.42) NR1H2NR1H3KLK7PARP1AGTR2
SCHEMBL8061462 0.81 POLB (0.43) NR1H2NR1H3KLK7PARP1AGTR2
SCHEMBL30181418 0.81 POLB (0.43) NR1H2NR1H3KLK7PARP1AGTR2
SCHEMBL28795618 0.81 POLB (0.43) NR1H2NR1H3KLK7PARP1AGTR2
SCHEMBL30207229 0.81 POLB (0.43) NR1H2NR1H3KLK7PARP1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260125391-A1 PYRIMIDINE INDOLES AS CDK4 INHIBITORS INCYTE CORP (US) 2026-05-07 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-20260125391-A1 PYRIMIDINE INDOLES AS CDK4 INHIBITORS CDK4, CCNA1, CCNO NR1H2 804/4885NR1H3 635/4885KLK7 4653/4885

“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.