SCHEMBL4872369

SCHEMBL4872369

O=C(O)c1coc(-c2ccc(F)c(C(F)(F)F)c2)n1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMO O15229 3/20 0.55
MPL P40238 3/20 0.47
HDAC1 Q13547 6/20 0.44
HDAC8 Q9BY41 6/20 0.44
HDAC6 Q9UBN7 6/20 0.44
ALDH1A1 P00352 1/20 0.41
RIPK1 Q13546 1/20 0.41
RARA P10276 1/20 0.41
RARB P10826 1/20 0.41
RARG P13631 1/20 0.41
PTPN1 P18031 1/20 0.40
PDE4B Q07343 1/20 0.39
ASPH Q12797 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
SCHEMBL2638419 0.85 NOTUM (0.52) KMOHDAC1HDAC8HDAC6ALDH1A1
SCHEMBL4870877 0.85 NOTUM (0.47) KMOMPLHDAC1HDAC8HDAC6
SCHEMBL12521389 0.82 S1PR1 (0.50) HDAC1HDAC8HDAC6ALDH1A1RARA
SCHEMBL628001 0.81 LMNA (0.46) KMOMPL
SCHEMBL2871079 0.79 ALDH1A1 (0.50) HDAC1HDAC8HDAC6ALDH1A1PTPN1
SCHEMBL19556359 0.78 KMO (0.53) KMOHDAC1HDAC8HDAC6ALDH1A1
SCHEMBL30112055 0.78 KMO (0.53) KMOHDAC1HDAC8HDAC6ALDH1A1
SCHEMBL28038942 0.77 HDAC1 (0.43) HDAC1HDAC8HDAC6ALDH1A1PTPN1
SCHEMBL31604686 0.77 KMO (0.54) KMOHDAC1HDAC8HDAC6ALDH1A1
SCHEMBL2638950 0.77 KMO (0.54) KMOHDAC1HDAC8HDAC6ALDH1A1

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
EP-2307394-B1 SULPHONAMIDES AS VANILLOID RECEPTOR ANTAGONIST AMOREPACIFIC CORP (KR) 2012-09-26 EP disclosed
US-20080076771-A1 Thrombopoietin Receptor Agonists REITER LAWRENCE A 2008-03-27 US disclosed
EP-1794156-A2 TROMBOPOIETIN RECEPTOR AGONISTS Pfizer Products Incorporated (US) 2007-06-13 EP disclosed
WO-2006033005-A2 THROMBOPOIETIN RECEPTOR AGONISTS PFIZER PRODUCTS INC. (US) 2006-03-30 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-20080076771-A1 Thrombopoietin Receptor Agonists MPL, THPO, TBXA2R KMO 4386/4885MPL 1/4885HDAC1 3402/4885

“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.