SCHEMBL22639991

SCHEMBL22639991

Cc1nc2c(C(=O)O)cc(-c3ccccc3O)nc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 17/20 0.59
▸ TACR3 P29371 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 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
SCHEMBL22639976 0.80 DHODH (0.50) DHODHTACR3KDM4EHPGDHSD17B10
SCHEMBL23458441 0.75 POLB (0.58) DHODHKDM4EHPGD
SCHEMBL17211724 0.75 CYP2D6 (0.56) DHODHKDM4EHPGDHSD17B10
SCHEMBL21905205 0.74 DHODH (1.00) DHODH
SCHEMBL19520848 0.71 MEN1 (0.73) DHODHTACR3KDM4EHPGDHSD17B10
SCHEMBL27583672 0.70 KDM4E (0.44) DHODHKDM4EHPGDHSD17B10
SCHEMBL29893885 0.67 DHODH (0.44) DHODHKDM4E
SCHEMBL10212018 0.66 DHODH (0.78) DHODH
SCHEMBL21974417 0.66 DHODH (0.97) DHODH
SCHEMBL8312271 0.66 MEN1 (0.53) DHODHTACR3KDM4EHPGDHSD17B10

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-10828281-B2 Non-hydrophobic compounds for use in treating metastasis and/or cartilage defect Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2020-11-10 — — 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-10828281-B2 Non-hydrophobic compounds for use in treating metastasis and/or cartilage defect VIM, MATR3, TP53 DHODH 1020/4885TACR3 4052/4885KDM4E 4343/4885

“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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