SCHEMBL23453755

SCHEMBL23453755

Cc1onc(C(=O)O)c1N(Cc1ccc(Oc2ccc(C#N)cc2)cc1)Cc1ccc(Oc2ccc(C#N)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 1/20 0.43
▸ SNCA P37840 1/20 0.41
▸ CACNA1B Q00975 2/20 0.39
▸ CACNA1H O95180 1/20 0.39
▸ NR3C1 P04150 3/20 0.38
▸ PGR P06401 1/20 0.38
▸ PARP15 Q460N3 1/20 0.38
▸ PARP10 Q53GL7 1/20 0.38
▸ PARP2 Q9UGN5 1/20 0.38
▸ MAPK1 P28482 2/20 0.37
▸ USP2 O75604 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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 0.78 VNN1 (0.46) PTGER4CACNA1BCACNA1HMAPK1SMN1; SMN2
SCHEMBL22609336 0.74 POLB (0.48) PTGER4PARP15PARP10PARP2MAPK1
SCHEMBL27213630 0.72 NSD2 (0.55) SNCACACNA1BCACNA1HNR3C1PGR
SCHEMBL23453716 0.70 PTGER4 (0.45) PTGER4MAPK1USP2SMN1; SMN2HIF1A
SCHEMBL22609285 0.67 SRD5A2 (0.51) MEN1KMT2AALDH1A1
SCHEMBL6917099 0.66 SRD5A2 (0.57) NR3C1PARP15PARP10PARP2MAPK1
SCHEMBL22609268 0.65 DHODH (0.43) SMN1; SMN2KDM4ELMNAPOLBMAPT
SCHEMBL30947346 0.64 NSD2 (0.48) SNCACACNA1BCACNA1HNR3C1PGR
SCHEMBL8375488 0.64 LMNA (0.54) MAPK1SMN1; SMN2KDM4ELMNAPOLB
SCHEMBL505264 0.64 PARP15 (0.71) PARP15PARP10PARP2MAPK1KDM4E

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
US-20210171503-A1 GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF ORFAN BIOTECH SL (ES) 2021-06-10 — — US disclosed
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 PTGER4 1108/4885SNCA 4855/4885CACNA1B 2419/4885

“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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