SCHEMBL18987698

SCHEMBL18987698

CCOC(=O)c1cnc2cc(OC(F)(F)F)ccc2c1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.54
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
MAPT P10636 5/20 0.49
PDE6D O43924 1/20 0.46
PDE5A O76074 1/20 0.46
PDE6A P16499 1/20 0.46
PDE6G P18545 1/20 0.46
PDE6B P35913 1/20 0.46
PDE6C P51160 1/20 0.46
PDE6H Q13956 1/20 0.46
MAPK10 P53779 1/20 0.45
THRB P10828 2/20 0.45
GAA P10253 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ELANE P08246 1/20 0.43
CA2 P00918 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 2/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL29409630 0.91 TP53 (0.62) TP53MEN1KMT2AMAPTMAPK10
SCHEMBL6314401 0.91 TP53 (0.62) TP53MEN1KMT2AMAPTMAPK10
SCHEMBL29409637 0.91 TP53 (0.62) TP53MEN1KMT2AMAPTMAPK10
SCHEMBL18987983 0.88 MEN1 (0.51) TP53MEN1KMT2AMAPTMAPK10
SCHEMBL1983426 0.87 TP53 (0.55) TP53MEN1KMT2AMAPTPDE6D
SCHEMBL1467397 0.87 KMT2A (0.54) TP53MEN1KMT2AMAPTMAPK10
SCHEMBL18285401 0.85 KMT2A (0.52) TP53MEN1KMT2AMAPTMAPK10
SCHEMBL29896404 0.85 KMT2A (0.52) TP53MEN1KMT2AMAPTMAPK10
SCHEMBL12510098 0.85 LMNA (0.53) MEN1KMT2AMAPTMAPK10GAA
SCHEMBL429137 0.85 PDE5A (0.60) MEN1KMT2AMAPTPDE6DPDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3390384-B1 QUINOLINE-3-CARBOXAMIDES AS H-PGDS INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2021-09-15 EP disclosed
EP-3390384-B1 QUINOLINE-3-CARBOXAMIDES AS H-PGDS INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2021-09-15 EP disclosed
US-20210238162-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-08-05 US disclosed
US-20210238162-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-08-05 US disclosed
EP-3390384-A1 QUINOLINE-3-CARBOXAMIDES AS H-PGDS INHIBITORS Astex Therapeutics Limited (GB) 2018-10-24 EP disclosed
WO-2017103851-A1 QUINOLINE-3-CARBOXAMIDES AS H-PGDS INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2017-06-22 WO disclosed
WO-2017103851-A1 QUINOLINE-3-CARBOXAMIDES AS H-PGDS INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2017-06-22 WO 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-20210238162-A1 CHEMICAL COMPOUNDS HPGDS, PTGS1, PTGIS TP53 4290/4885MEN1 4059/4885KMT2A 1026/4885

“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.