SCHEMBL35210768

SCHEMBL35210768

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

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 5/20 0.44
KLK7 P49862 1/20 0.41
NR1H2 P55055 2/20 0.39
NR1H3 Q13133 2/20 0.39
PARP1 P09874 1/20 0.39
PDK1 Q15118 1/20 0.39
PDK2 Q15119 1/20 0.39
PDK3 Q15120 1/20 0.39
PDK4 Q16654 1/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
RORC P51449 1/20 0.38
AGTR2 P50052 1/20 0.37
STS P08842 1/20 0.36
ABCB1 P08183 1/20 0.36
ABHD6 Q9BV23 1/20 0.36
DAGLA Q9Y4D2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PPARA Q07869 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
SCHEMBL35210684 0.86 TACR1 (0.46) TACR1KLK7NR1H2NR1H3PARP1
SCHEMBL35211172 0.83 KLK7 (0.42) TACR1KLK7NR1H2NR1H3PARP1
SCHEMBL35210538 0.83 NR1H2 (0.42) TACR1KLK7NR1H2NR1H3PARP1
SCHEMBL14199452 0.83 KLK7 (0.47) TACR1KLK7NR1H2NR1H3PARP1
SCHEMBL28549464 0.80 PARP1 (0.46) KLK7NR1H2NR1H3PARP1JAK2
SCHEMBL35211370 0.77 TACR1 (0.44) TACR1NR1H2
SCHEMBL7301938 0.76 KLK7 (0.47) KLK7PARP1JAK2JAK1STS
SCHEMBL7297892 0.76 KLK7 (0.47) KLK7PARP1JAK2JAK1STS
SCHEMBL31228495 0.76 KLK7 (0.46) KLK7NR1H2NR1H3PARP1JAK2
SCHEMBL31228337 0.76 KLK7 (0.46) KLK7NR1H2NR1H3PARP1JAK2

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 TACR1 1587/4885KLK7 4653/4885NR1H2 804/4885

“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.