SCHEMBL22609264

SCHEMBL22609264

COC(=O)c1noc(C)c1Nc1ccc(-c2ccc(C#N)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.43
▸ TP53 P04637 4/20 0.41
▸ THRB P10828 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ GSK3B P49841 1/20 0.40
▸ DHODH Q02127 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ CISD2 Q8N5K1 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ CYP11B1 P15538 1/20 0.37
▸ CYP11B2 P19099 1/20 0.37
▸ EGLN2 Q96KS0 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ EGLN1 Q9GZT9 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
SCHEMBL22609316 0.96 DHODH (0.41) RXFP1TP53THRBGSK3BDHODH
SCHEMBL23453717 0.88 DHODH (0.41) RXFP1TP53CYP2C9CYP2C19GSK3B
SCHEMBL22609268 0.84 DHODH (0.43) RXFP1TP53GSK3BDHODHALOX15
SCHEMBL22609248 0.81 ALDH1A1 (0.38) CYP2C9CYP2C19HSD17B10MAPTMEN1
SCHEMBL22609336 0.80 POLB (0.48) RXFP1TP53DHODHALOX15HSD17B10
SCHEMBL22609245 0.80 MAPT (0.45) RXFP1TP53DHODHMAPTPOLB
SCHEMBL23453703 0.77 ALDH1A1 (0.47) ALOX15HSD17B10POLBIDO1
SCHEMBL18091779 0.76 TP53 (0.44) RXFP1TP53THRBMAPTCISD2
SCHEMBL23486582 0.74 DHODH (0.38) RXFP1CYP2C9CYP2C19GSK3BDHODH
SCHEMBL20530970 0.74 GSK3B (0.45) RXFP1GSK3BDHODHMAPTCISD2

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
EP-3731840-A1 GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF Orfan Biotech Inc. (US) 2020-11-04 — — EP 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 RXFP1 2736/4885TP53 3308/4885THRB 2284/4885

“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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