SCHEMBL3406590

SCHEMBL3406590

COC(=O)[C@H](Cn1c(=O)cnc2ccc(OC)cc21)NC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 5/20 0.43
HPGD P15428 3/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
DYRK1A Q13627 1/20 0.40
BRD4 O60885 2/20 0.40
HSD17B10 Q99714 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL3779719 1.00 KDM4E (0.43) KDM4EALDH1A1HPGDLMNATHRB
SCHEMBL3780649 0.92 PPARG (0.45) KDM4EALDH1A1HPGDLMNATHRB
SCHEMBL3405061 0.92 PPARG (0.45) KDM4EALDH1A1HPGDLMNATHRB
SCHEMBL603590 0.78 PIK3CA (0.46) KDM4EALDH1A1
SCHEMBL603591 0.78 PIK3CA (0.46) KDM4EALDH1A1
SCHEMBL15850919 0.75 KCNA5 (0.43) KDM4EALDH1A1HSD17B10MTNR1AMTNR1B
SCHEMBL10285563 0.73 KCNH2 (0.58)
SCHEMBL15850921 0.72 HTR1A (0.41) KDM4EALDH1A1HSD17B10MTNR1AMTNR1B
SCHEMBL12065370 0.71 KDM4E (0.62) KDM4EALDH1A1HPGDHSD17B10ALOX15
SCHEMBL23963101 0.71 PPARG (0.44) ALDH1A1LMNAPPARGPPARAHDAC1

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
EP-2254887-B9 OXAZOLIDINONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2013-05-29 EP disclosed
US-8349826-B2 Oxazolidinone derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2013-01-08 US disclosed
EP-2254887-B1 OXAZOLIDINONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-12-19 EP disclosed
US-20100331308-A1 OXAZOLIDINONE DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-12-30 US disclosed
EP-2254887-A1 OXAZOLIDINONE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2010-12-01 EP disclosed
WO-2009104159-A1 OXAZOLIDINONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2009-08-27 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-20100331308-A1 OXAZOLIDINONE DERIVATIVES OXA1L, UQCRB, O60361 KDM4E 2765/4885ALDH1A1 367/4885HPGD 988/4885

“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.