SCHEMBL23958886

SCHEMBL23958886

COc1cc(C(=O)NCC(O)(c2cc(C(C)(C)O)c(F)c(-c3ccc(F)cc3)n2)C(C)(F)F)cc2cc(C)nnc12

nearest known ligand 0.94

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CFTR P13569 4/20 0.40
MAPT P10636 1/20 0.34
PTGFR P43088 5/20 0.33
CNR2 P34972 2/20 0.33
SCN9A Q15858 1/20 0.33
NR3C1 P04150 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
GABRA5 P31644 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 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
SCHEMBL25687478 1.00 CFTR (0.40) CFTRMAPTPTGFRCNR2SCN9A
SCHEMBL25687479 1.00 CFTR (0.40) CFTRMAPTPTGFRCNR2SCN9A
SCHEMBL25687518 0.97 CFTR (0.40) CFTRMAPTPTGFRCNR2SCN9A
SCHEMBL25686197 0.97 CFTR (0.40) CFTRMAPTPTGFRCNR2SCN9A
SCHEMBL30211296 0.97 CFTR (0.40) CFTRMAPTPTGFRCNR2SCN9A
SCHEMBL30007155 0.91 CFTR (0.38) CFTRMAPTPTGFRCNR2SCN9A
SCHEMBL28909119 0.91 CFTR (0.38) CFTRMAPTPTGFRCNR2SCN9A
SCHEMBL25687410 0.91 MAPT (0.37) CFTRMAPTPOLB
SCHEMBL23958707 0.90 CFTR (0.39) CFTRMAPTPTGFRCNR2SCN9A
SCHEMBL25687310 0.90 CFTR (0.39) CFTRMAPTPTGFRCNR2SCN9A

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 3 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
CN-115461336-A RSV inhibiting 3-substituted quinoline and cinnoline derivatives 爱尔兰詹森科学公司 2022-12-09 CN 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 CFTR 508/4885MAPT 4162/4885PTGFR 3859/4885

“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.