SCHEMBL9502058

SCHEMBL9502058

CCOC(=O)c1cn(C2CC2)c2cc(F)c(F)c(NCc3ccccc3)c2c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.48
GSK3B P49841 8/20 0.46
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HTT P42858 1/20 0.40
CASP3 P42574 2/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
IKBKB O14920 1/20 0.39
AURKA O14965 1/20 0.39
CHUK O15111 1/20 0.39
MAPK13 O15264 1/20 0.39
DAPK3 O43293 1/20 0.39
PRKCG P05129 1/20 0.39

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
SCHEMBL1345409 0.94 ADRB2 (0.43) ADRB2GSK3BALDH1A1LMNAMAPT
SCHEMBL9501093 0.89 GSK3B (0.54) GSK3BKDM4EIKBKBAURKACHUK
SCHEMBL9501162 0.88 ADRB2 (0.46) ADRB2GSK3BALDH1A1LMNAMAPT
SCHEMBL1345135 0.86 GSK3B (0.50) ADRB2GSK3BALDH1A1LMNAMAPT
SCHEMBL25069770 0.86 ALDH1A1 (0.46) ALDH1A1LMNAMAPTHPGDL3MBTL1
SCHEMBL5704357 0.86 GSK3B (0.48) ADRB2GSK3BALDH1A1LMNAMAPT
SCHEMBL1243138 0.85 LMNA (0.46) ALDH1A1LMNAMAPTHPGDL3MBTL1
SCHEMBL25069320 0.84 ALDH1A1 (0.44) ALDH1A1LMNAMAPTHPGDL3MBTL1
SCHEMBL25069650 0.84 ALDH1A1 (0.44) ALDH1A1LMNAMAPTHPGDL3MBTL1
SCHEMBL9501129 0.84 ADRB2 (0.51) ADRB2GSK3BALDH1A1LMNAMAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230058189-A1 QUINOLIN-4-ONE AND 4(1H)-CINNOLINONE COMPOUNDS AND METHODS OF USING SAME Frequency Therapeutics, Inc. (US) 2023-02-23 US disclosed
EP-0312085-B1 NOVEL QUINOLINE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND ANTIBACTERIAL AGENT CONTAINING THEM Dainippon Pharmaceutical Co., Ltd. (JP) 1993-05-12 EP disclosed
US-5164392-A Active against streptococci and staphylococci DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1992-11-17 US disclosed
US-5013841-A Oxo quinoline derivatives DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1991-05-07 US disclosed
EP-0312085-A2 Novel quinoline derivatives, processes for preparation thereof and antibacterial agent containing them Dainippon Pharmaceutical Co., Ltd. (JP) 1989-04-19 EP 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-20230058189-A1 QUINOLIN-4-ONE AND 4(1H)-CINNOLINONE COMPOUNDS AND METHODS OF USING SAME DCX, NES, MCL1 ADRB2 4044/4885GSK3B 1102/4885ALDH1A1 102/4885

“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.