SCHEMBL23958715

SCHEMBL23958715

CC(C)(C)OC(=O)NCC(O)(c1cc(C(C)(C)O)c(F)c(Cl)n1)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.39
CACNA1B Q00975 1/20 0.39
CACNA1C Q13936 1/20 0.39
KDM4A O75164 1/20 0.34
STK17B O94768 1/20 0.34
STK17A Q9UEE5 1/20 0.34
EPAS1 Q99814 1/20 0.34
AAK1 Q2M2I8 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
GRM2 Q14416 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32
MAPKAPK2 P49137 2/20 0.32
LATS1 O95835 1/20 0.32
RORC P51449 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL25423081 0.87 CFTR (0.34) RORC
SCHEMBL23958725 0.83 ACACB (0.36) CACNA1HCACNA1BCACNA1CKDM4ASTK17B
SCHEMBL30471289 0.83 ACACB (0.36) CACNA1HCACNA1BCACNA1CKDM4ASTK17B
SCHEMBL23958697 0.83 CFTR (0.44) CACNA1HCACNA1BCACNA1CGRM2LATS1
SCHEMBL25686690 0.81 GABRA5 (0.36) CACNA1HCACNA1BCACNA1CAAK1TRPV1
SCHEMBL30471272 0.81 GABRA5 (0.36) CACNA1HCACNA1BCACNA1CAAK1TRPV1
SCHEMBL25686708 0.81 GABRA5 (0.36) CACNA1HCACNA1BCACNA1CAAK1TRPV1
SCHEMBL25686536 0.81 CFTR (0.42) CACNA1HCACNA1BCACNA1CEPAS1AAK1
SCHEMBL30692529 0.77
SCHEMBL25279779 0.77

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 CACNA1H 2876/4885CACNA1B 1811/4885CACNA1C 1283/4885

“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.