SCHEMBL22016172

SCHEMBL22016172

CCc1c(C(F)(F)F)c2c(n(C)c1=O)CCC2

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ LMNA P02545 3/20 0.32
▸ TSHR P16473 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ HTT P42858 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ PABPC1 P11940 1/20 0.31
▸ APOBEC3A P31941 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ APOBEC3G Q9HC16 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL13377320 0.81 RXFP1 (0.36) RXFP1LMNATSHRNPSR1SMN1; SMN2
SCHEMBL21956885 0.78 RXFP1 (0.35) RXFP1LMNATSHRNPSR1
SCHEMBL13377365 0.78 RXFP1 (0.40) RXFP1LMNATSHRNPSR1HTT
SCHEMBL22017353 0.76 POLB (0.35) RXFP1LMNATSHRNPSR1
SCHEMBL28591800 0.75 MAPT (0.38) RXFP1TDP1LMNATSHRNPSR1
SCHEMBL23847338 0.69 MAPT (0.33) TDP1
SCHEMBL16381205 0.66 RAB9A (0.38) LMNANPSR1HTTRAB9ACYP1A2
SCHEMBL22035529 0.66 KDM5B (0.31) —
SCHEMBL13377306 0.65 RXFP1 (0.33) RXFP1LMNATSHRNPSR1
SCHEMBL21957120 0.65 AR (0.41) RXFP1TDP1HTT

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 RXFP1 2319/4885TDP1 2395/4885LMNA 2900/4885
US-20200155538-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 RXFP1 2319/4885TDP1 2395/4885LMNA 2900/4885
US-11116760-B2 Quinoline derivatives CFTR, NQO1, IRF3 RXFP1 2319/4885TDP1 2395/4885LMNA 2900/4885

“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.

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