SCHEMBL5751946

SCHEMBL5751946

CC1(C)OC2CCC(c3ccc(NC(=O)OCc4ccccc4)cc3F)CC2O1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45
RAB9A P51151 1/20 0.45
ATM Q13315 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MGLL Q99685 3/20 0.45
KDM1A O60341 3/20 0.43
MAOA P21397 3/20 0.43
MAOB P27338 2/20 0.43
HRH3 Q9Y5N1 2/20 0.43
RCOR1 Q9UKL0 2/20 0.42
KDM1B Q8NB78 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.41
ENPP2 Q13822 2/20 0.41
ROCK2 O75116 1/20 0.40
RORC P51449 1/20 0.40

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
SCHEMBL5749189 0.85 HRH3 (0.58) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL5592154 0.79 MGLL (0.54) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL5592075 0.79 MGLL (0.51) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL5592090 0.78 MGLL (0.53) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL7689833 0.78 MGLL (0.52) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL5592097 0.77 MGLL (0.54) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL5730852 0.77 MGLL (0.54) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL5737794 0.77 SMN1; SMN2 (0.46) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL5737854 0.77 NPC1 (0.42) NPC1ALDH1A1TP53MAPTTSHR
SCHEMBL6399085 0.75 MGLL (0.51) NPC1ALDH1A1TP53MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1660488-A1 NOVEL ANTIMICROBIAL ARYLOXAZOLIDINONE COMPOUNDS Warner-Lambert Company LLC (US) 2006-05-31 EP disclosed
US-20050065187-A1 Novel antimicrobial aryloxazolidinone compounds GORDEEV MIKHAIL FEDOROVICH (US) 2005-03-24 US disclosed
WO-2005019214-A1 NOVEL ANTIMICROBIAL ARYLOXAZOLIDINONE COMPOUNDS WARNER-LAMBERT COMPANY LLC (US) 2005-03-03 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-20050065187-A1 Novel antimicrobial aryloxazolidinone compounds XDH, NQO1, MPO NPC1 1209/4885ALDH1A1 723/4885TP53 4878/4885

“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.