SCHEMBL15670482

SCHEMBL15670482

COC(=O)C(NC(=O)OC(C)(C)C)c1ccc(F)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4D Q6B0I6 1/20 0.41
CTSS P25774 4/20 0.40
CTSK P43235 4/20 0.40
TRPA1 O75762 1/20 0.39
AAK1 Q2M2I8 1/20 0.38
KLK5 Q9Y337 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
S1PR3 Q99500 1/20 0.37
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
NR3C2 P08235 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL30697603 0.88 TRPA1 (0.38) CTSSCTSKTRPA1AAK1KLK5
SCHEMBL2891444 0.88 TRPA1 (0.38) CTSSCTSKTRPA1AAK1KLK5
SCHEMBL2898663 0.88 TRPA1 (0.38) CTSSCTSKTRPA1AAK1KLK5
SCHEMBL3822263 0.88 CTSS (0.43) KDM4DCTSSCTSKTRPA1AAK1
SCHEMBL29571131 0.88 CTSS (0.43) KDM4DCTSSCTSKTRPA1AAK1
SCHEMBL27189474 0.87 TRPA1 (0.38) CTSSCTSKTRPA1AAK1KLK5
SCHEMBL29483428 0.87 KDM4D (0.41) KDM4DCTSSCTSKTRPA1AAK1
SCHEMBL1115364 0.87 KDM4D (0.41) KDM4DCTSSCTSKTRPA1AAK1
SCHEMBL23969949 0.85 AAK1 (0.40) KDM4DCTSSCTSKTRPA1AAK1
SCHEMBL15670451 0.84 CTSS (0.45) CTSSCTSKKLK5S1PR3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200171028-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS HOLDINGS, LLC 2020-06-04 US disclosed
EP-2912034-B1 3,4-DISUBSTITUTED OXAZOLIDINONE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE CALCIUM ACTIVATED POTASSIUM CHANNEL HOFFMANN LA ROCHE (CH) 2017-05-31 EP disclosed
US-9611232-B2 Oxazolidinone and imidazolidinone compounds HOFFMANN-LA ROCHE INC. (US) 2017-04-04 US disclosed
US-20150246894-A1 NOVEL OXAZOLIDINONE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2015-09-03 US disclosed
EP-2912034-A1 3,4-DISUBSTITUTED OXAZOLIDINONE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE CALCIUM ACTIVATED POTASSIUM CHANNEL F. Hoffmann-La Roche AG (CH) 2015-09-02 EP disclosed
WO-2014067861-A1 3,4-DISUBSTITUTED OXAZOLIDINONE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE CALCIUM ACTIVATED POTASSIUM CHANNEL F. HOFFMANN-LA ROCHE AG (CH) 2014-05-08 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 (2 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-20150246894-A1 NOVEL OXAZOLIDINONE COMPOUNDS OXA1L, CDK11B, CDK11A KDM4D 2606/4885CTSS 4536/4885CTSK 3065/4885
US-20200171028-A1 METALLOENZYME INHIBITOR COMPOUNDS HDAC6, HDAC1, HDAC2 KDM4D 3433/4885CTSS 431/4885CTSK 249/4885

“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.