SCHEMBL22016535

SCHEMBL22016535

CC(C)N1C(=O)N(C)c2cc(CC(C)n3c(=O)c4cnccc4n(C)c3=O)cnc2C1O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.34
CMA1 P23946 2/20 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
SCHEMBL22017691 0.70 GRM4 (0.44) GRM4CMA1
SCHEMBL22017689 0.64 ADORA3 (0.45)
SCHEMBL9534299 0.63 ADORA3 (0.49) GRM4
SCHEMBL22016877 0.61 ADORA3 (0.41) CMA1
SCHEMBL22016876 0.61 AAK1 (0.40) CMA1
SCHEMBL22016873 0.59 AAK1 (0.39) CMA1
SCHEMBL13322657 0.58 MAPK14 (0.40) GRM4
SCHEMBL13322656 0.58 HPD (0.42) GRM4
SCHEMBL22016240 0.55 GRM4 (0.43) GRM4CMA1
SCHEMBL23471345 0.55 KAT2B (0.36) GRM4

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-20230041518-A1 QUINOLINE DERIVATIVES GILEAD SCIENCES, INC. 2023-02-09 US disclosed
US-11116760-B2 Quinoline derivatives GILEAD SCIENCES, INC. (US) 2021-09-14 US disclosed
US-20200155538-A1 QUINOLINE DERIVATIVES GILEAD SCIENCES, INC. 2020-05-21 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 (3 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-20230041518-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 GRM4 3533/4885CMA1 146/4885
US-20200155538-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 GRM4 3533/4885CMA1 146/4885
US-11116760-B2 Quinoline derivatives CFTR, NQO1, IRF3 GRM4 3533/4885CMA1 146/4885

“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.