SCHEMBL23486613

SCHEMBL23486613

Cc1onc(C(=O)OCc2onc(C(=O)O)c2NCc2ccc(Oc3ccc(C#N)cc3)cc2)c1SCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ PTGER4 P35408 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ VNN1 O95497 1/20 0.34
▸ CACNA1B Q00975 4/20 0.33
▸ TSHR P16473 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CACNA1H O95180 1/20 0.32
▸ CNR1 P21554 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ ALOX5AP P20292 1/20 0.32

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
SCHEMBL23453702 0.79 VNN1 (0.46) SMN1; SMN2LMNAHTTPTGER4KDM4E
SCHEMBL22609227 0.70 ALDH1A1 (0.47) SMN1; SMN2LMNAHTTKDM4EMEN1
SCHEMBL22609214 0.69 PPARG (0.43) SMN1; SMN2LMNAKDM4EMEN1KMT2A
SCHEMBL22609336 0.67 POLB (0.48) LMNAPTGER4KDM4EMEN1KMT2A
SCHEMBL23453755 0.65 PTGER4 (0.43) SMN1; SMN2LMNAPTGER4KDM4EMEN1
SCHEMBL22609253 0.60 ALDH1A1 (0.52) SMN1; SMN2HTTKDM4EKMT2AALDH1A1
SCHEMBL22609268 0.60 DHODH (0.43) SMN1; SMN2LMNAHTTKDM4ETSHR
SCHEMBL22609285 0.59 SRD5A2 (0.51) MEN1KMT2ATSHRALDH1A1GAA
SCHEMBL851812 0.59 MAPT (0.47) SMN1; SMN2LMNAHTTMEN1KMT2A
SCHEMBL17296519 0.59 CA1 (0.58) SMN1; SMN2LMNAMEN1KMT2ATSHR

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-20210171503-A1 GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF ORFAN BIOTECH SL (ES) 2021-06-10 — — 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-20210171503-A1 GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF PNPO, XDH, GLS SMN1; SMN2 4815/4885LMNA 3881/4885HTT 4735/4885

“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.

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