SCHEMBL3334273

SCHEMBL3334273

C=C(CC1CN(c2ccc3c(c2)NC(=O)CS3)C(=O)O1)C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.41
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 4/20 0.38
TRPV1 Q8NER1 1/20 0.37
HPGD P15428 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
F10 P00742 1/20 0.35
CALML3 P27482 2/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL3334275 1.00 HTT (0.41) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL592115 0.88 HTT (0.47) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL592114 0.88 HTT (0.47) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL3334008 0.85 HTT (0.42) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL1723608 0.85 HTT (0.42) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL3328496 0.85 HTT (0.42) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL2170757 0.84 F10 (0.46) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL592187 0.84 MAOA (0.51) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL592186 0.84 MAOA (0.51) HTTALDH1A1LMNAPOLBTRPV1
SCHEMBL590435 0.84 F10 (0.46) HTTALDH1A1LMNAPOLBTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 HTT 3101/4885ALDH1A1 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.