SCHEMBL23958975

SCHEMBL23958975

CC(C)(O)c1cc([C@@](O)(CN)C2CC2)nc(-c2ccc(C3CC3)cc2)c1F

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 11/20 0.34
SOAT1 P35610 5/20 0.34
FAAH O00519 1/20 0.32
CHRM2 P08172 1/20 0.32
DGAT2 Q96PD7 1/20 0.32
PDE10A Q9Y233 1/20 0.32
DHODH Q02127 1/20 0.31
TLR9 Q9NR96 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
KCNK3 O14649 1/20 0.30
KCNK9 Q9NPC2 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL23958767 1.00 DGAT1 (0.34) DGAT1SOAT1FAAHCHRM2DGAT2
SCHEMBL25686955 0.90 CFTR (0.34) CYP11B1CYP11B2
SCHEMBL23958790 0.90 CFTR (0.34) CYP11B1CYP11B2
SCHEMBL23958632 0.90 CFTR (0.34) CYP11B1CYP11B2
SCHEMBL25686991 0.88 PRKACA (0.33) FAAH
SCHEMBL23958854 0.88 PRKACA (0.33) FAAH
SCHEMBL23958657 0.87 TRPV1 (0.33) DHODH
SCHEMBL23958735 0.87 TRPV1 (0.33) DHODH
SCHEMBL23958871 0.86 CSNK1E (0.31)
SCHEMBL23958704 0.86 CSNK1E (0.31)

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 DGAT1 4520/4885SOAT1 3594/4885FAAH 3180/4885

“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.