SCHEMBL18589529

SCHEMBL18589529

CCOC(=O)c1c[nH]c2ccc(OC(F)(F)F)cc2c1=O

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.68
GABRB2 P47870 4/20 0.68
GABRB1 P18505 3/20 0.67
GABRA3 P34903 3/20 0.67
MEN1 O00255 1/20 0.59
ALDH1A1 P00352 1/20 0.59
TP53 P04637 1/20 0.59
HPGD P15428 1/20 0.59
KMT2A Q03164 1/20 0.59
HSD17B10 Q99714 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
KDM4E B2RXH2 1/20 0.54
HTT P42858 1/20 0.53
CLEC4M Q9H2X3 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL17338558 0.89 GABRA1 (0.75) GABRA1GABRB2GABRB1GABRA3MEN1
SCHEMBL3847939 0.86 GABRA1 (0.73) GABRA1GABRB2GABRB1GABRA3MEN1
SCHEMBL25201098 0.85 GABRA1 (0.71) GABRA1GABRB2GABRB1GABRA3MEN1
SCHEMBL25195018 0.85 GABRA1 (0.61) GABRA1GABRB2GABRB1GABRA3MEN1
SCHEMBL25193812 0.85 GABRA1 (0.60) GABRA1GABRB2GABRB1GABRA3MEN1
SCHEMBL28289134 0.84 GABRA1 (0.70) GABRA1GABRB2GABRB1GABRA3MEN1
SCHEMBL22589629 0.84 KDM4E (0.62) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL29366524 0.84 KDM4E (0.62) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL846416 0.83 GABRA1 (0.74) GABRA1GABRB2GABRB1GABRA3MEN1
SCHEMBL25184813 0.82 GABRA1 (0.55) GABRA1GABRB2GABRB1GABRA3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12486234-B2 PAPD5 inhibitors and methods of use thereof CHILDREN'S MEDICAL CENTER CORPORATION (US) 2025-12-02 US disclosed
CN-119798159-A PAPD5 inhibitors and methods of use thereof 儿童医学中心公司 2025-04-11 CN disclosed
US-20220274928-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION 2022-09-01 US disclosed
EP-3959197-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2022-03-02 EP disclosed
CN-113993848-A Inhibitors of PAPD5 and methods of use thereof 儿童医学中心公司 2022-01-28 CN disclosed
WO-2020219729-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2020-10-29 WO disclosed
WO-2020219729-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2020-10-29 WO disclosed
US-20170066722-A1 AGENTS FOR USE IN THE TREATMENT OF CARDIOVASCULAR AND INFLAMMATORY DISEASES STRUCTURALLY BASED ON 4(1 H)-QUINOLONE UCL BUSINESS PLC (GB) 2017-03-09 US disclosed
US-20170066722-A1 AGENTS FOR USE IN THE TREATMENT OF CARDIOVASCULAR AND INFLAMMATORY DISEASES STRUCTURALLY BASED ON 4(1 H)-QUINOLONE UCL BUSINESS PLC (GB) 2017-03-09 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-20220274928-A1 PAPD5 INHIBITORS AND METHODS OF USE THEREOF POT1, PARP15, TERT GABRA1 4735/4885GABRB2 4741/4885GABRB1 4730/4885
US-20170066722-A1 AGENTS FOR USE IN THE TREATMENT OF CARDIOVASCULAR AND INFLAMMATORY DISEASES STRUCTURALLY BASED ON 4(1 H)-QUINOLONE CBR3, AGTR1, CBR1 GABRA1 1758/4885GABRB2 1514/4885GABRB1 1187/4885
US-12486234-B2 PAPD5 inhibitors and methods of use thereof POT1, PARP15, TERT GABRA1 4735/4885GABRB2 4741/4885GABRB1 4730/4885

“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.