SCHEMBL22016887

SCHEMBL22016887

Cc1c(F)cn(C)c(=O)c1C(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
KDM5B Q9UGL1 3/20 0.33
CREBBP Q92793 1/20 0.31
BRD4 O60885 4/20 0.30
TLR9 Q9NR96 1/20 0.30
TLR8 Q9NR97 1/20 0.30
TLR7 Q9NYK1 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
SCHEMBL22016780 0.78 LMNA (0.33) LMNAADORA3KDM5BBRD4
SCHEMBL21479571 0.71
SCHEMBL26714027 0.71 LMNA (0.32) LMNAADORA3
SCHEMBL26714122 0.69
SCHEMBL24869043 0.67 CREBBP (0.43) CREBBPBRD4
SCHEMBL18644923 0.65 FAAH (0.33) LMNAADORA3BRD4TLR9TLR8
SCHEMBL21479559 0.65
SCHEMBL20844030 0.65
SCHEMBL18651544 0.64 LMNA (0.41) LMNAADORA3KDM5BCREBBPBRD4
SCHEMBL22623683 0.63 BRD4 (0.43) LMNAADORA3BRD4

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 4 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-20220119383-A1 QUINOLINE DERIVATIVES AS ALPHA4BETA7 INTEGRIN INHIBITORS GILEAD SCIENCES, INC. 2022-04-21 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 (4 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 LMNA 2900/4885ADORA3 1752/4885KDM5B 1244/4885
US-20200155538-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 LMNA 2900/4885ADORA3 1752/4885KDM5B 1244/4885
US-20220119383-A1 QUINOLINE DERIVATIVES AS ALPHA4BETA7 INTEGRIN INHIBITORS ITGB7, ITGB1, ITGA2B LMNA 2991/4885ADORA3 1388/4885KDM5B 903/4885
US-11116760-B2 Quinoline derivatives CFTR, NQO1, IRF3 LMNA 2900/4885ADORA3 1752/4885KDM5B 1244/4885

“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.