SCHEMBL3332239

SCHEMBL3332239

CC(C)(C)OC(=O)NCCC(O)C1CN(c2ccc3c(c2)NC(=O)CS3)C(=O)O1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
DDB1 Q16531 2/20 0.36
CRBN Q96SW2 2/20 0.36
POLB P06746 3/20 0.36
MAPT P10636 1/20 0.35
F10 P00742 1/20 0.35
HTT P42858 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
DRD2 P14416 1/20 0.33

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
SCHEMBL3332237 1.00 HPGD (0.41) HPGDALDH1A1LMNAKMT2AMEN1
SCHEMBL592293 0.93 HPGD (0.39) HPGDALDH1A1LMNAKMT2AMEN1
SCHEMBL592294 0.93 HPGD (0.39) HPGDALDH1A1LMNAKMT2AMEN1
SCHEMBL591545 0.85 GRM2 (0.42) HPGDALDH1A1LMNAKMT2AMEN1
SCHEMBL592202 0.84 F10 (0.44) HPGDALDH1A1LMNAF10
SCHEMBL2169305 0.84 F10 (0.44) HPGDALDH1A1LMNAF10
SCHEMBL592203 0.84 F10 (0.44) HPGDALDH1A1LMNAF10
SCHEMBL3333028 0.81 HTT (0.40) HPGDALDH1A1LMNAPOLBMAPT
SCHEMBL3333023 0.81 HTT (0.40) HPGDALDH1A1LMNAPOLBMAPT
SCHEMBL592251 0.81 HTT (0.41) HPGDALDH1A1LMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146987-B1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2015-12-02 EP disclosed
US-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-06-03 US 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-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES OXA1L, XDH, CCNY HPGD 1730/4885ALDH1A1 1130/4885LMNA 2322/4885

“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.