SCHEMBL23958663

SCHEMBL23958663

CC(C)(C)OC(=O)NCC(O)(c1nc(-c2ccc(F)cc2)c(F)c(C(C)(C)O)c1F)C1CC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.37
CFTR P13569 3/20 0.36
CKS1B P61024 3/20 0.35
SKP1 P63208 3/20 0.35
SKP2 Q13309 3/20 0.35
PDK2 Q15119 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
LATS1 O95835 2/20 0.33
GRIA1 P42261 1/20 0.33
MIF P14174 1/20 0.33
LATS2 Q9NRM7 1/20 0.33
RORC P51449 1/20 0.33
SCN9A Q15858 1/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 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
SCHEMBL30471340 1.00 GRM2 (0.37) GRM2CFTRCKS1BSKP1SKP2
SCHEMBL30471261 0.93 GRM2 (0.36) GRM2CFTRCKS1BSKP1SKP2
SCHEMBL25686858 0.93 GRM2 (0.36) GRM2CFTRCKS1BSKP1SKP2
SCHEMBL25231387 0.89 CKS1B (0.36) CFTRCKS1BSKP1SKP2PDK2
SCHEMBL25686728 0.85 CFTR (0.41) GRM2CFTRCKS1BSKP1SKP2
SCHEMBL25686758 0.83 CFTR (0.40) GRM2CFTRCKS1BSKP1SKP2
SCHEMBL25234571 0.82 CKS1B (0.35) CFTRCKS1BSKP1SKP2PDK2
SCHEMBL23958787 0.80 SLC34A1 (0.33) CFTRPDK2
SCHEMBL30007885 0.80 SLC34A1 (0.33) CFTRPDK2
SCHEMBL25686999 0.80 SLC34A1 (0.33) CFTRPDK2

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-20230203004-A1 RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 US disclosed
WO-2021214136-A1 RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2021-10-28 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 (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-20230203004-A1 RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES ACE2, SIRT7, ACE GRM2 3975/4885CFTR 508/4885CKS1B 385/4885

“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.