SCHEMBL3403616

SCHEMBL3403616

CCOC(=O)CCn1c(=O)ccc2ccc(OC)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 7/20 0.46
MTNR1B P49286 7/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
TNF P01375 1/20 0.45
KMO O15229 1/20 0.44
DYRK1A Q13627 1/20 0.44
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
ALOX15 P16050 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 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
SCHEMBL12066303 0.87 ALDH1A1 (0.53) MTNR1AMTNR1BMAPTSMN1; SMN2NPSR1
SCHEMBL3409598 0.84 KMO (0.61) MTNR1AMTNR1BMAPTSMN1; SMN2NPSR1
SCHEMBL3405552 0.84 KAT2B (0.43) SMN1; SMN2TNFDYRK1AKMT2AALDH1A1
SCHEMBL3214955 0.84 KAT2B (0.43) MAPTSMN1; SMN2TNFKMT2AALDH1A1
SCHEMBL3404323 0.82 ALDH1A1 (0.54) MTNR1AMTNR1BMAPTTNFDYRK1A
SCHEMBL3229548 0.82 ALDH1A1 (0.51) TNFALDH1A1GAARAB9AKAT2B
SCHEMBL12066304 0.81 KDM4E (0.50) ALDH1A1
SCHEMBL10285843 0.80 MAPT (0.50) MTNR1AMTNR1BMAPTSMN1; SMN2NPSR1
SCHEMBL20710538 0.78 MAPT (0.67) MTNR1AMTNR1BMAPTSMN1; SMN2NPSR1
SCHEMBL2796210 0.76 ALDH1A1 (0.46) MTNR1AMTNR1BMAPTNPSR1ALDH1A1

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 MTNR1A 1771/4885MTNR1B 901/4885MAPT 3566/4885

“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.