SCHEMBL21296850

SCHEMBL21296850

O=C(O)c1nn[nH]c1Oc1cccc(-c2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMO O15229 7/20 0.44
BCL2L1 Q07817 1/20 0.40
MCL1 Q07820 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
DYRK3 O43781 1/20 0.39
CDK9 P50750 1/20 0.39
DYRK1A Q13627 1/20 0.39
DYRK2 Q92630 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
HAO1 Q9UJM8 5/20 0.39
CHEK2 O96017 1/20 0.39
EIF4E P06730 1/20 0.39
XDH P47989 2/20 0.38
PSD A5PKW4 1/20 0.37
SLC22A12 Q96S37 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
SCHEMBL29799107 1.00 KMO (0.44) KMOBCL2L1MCL1ADORA2AADORA1
SCHEMBL29799238 0.89 HAO1 (0.47) DYRK3CDK9DYRK1ADYRK2DYRK1B
SCHEMBL21296979 0.89 HAO1 (0.47) DYRK3CDK9DYRK1ADYRK2DYRK1B
SCHEMBL21296872 0.89 HAO1 (0.44) KMOBCL2L1MCL1HAO1XDH
SCHEMBL29799241 0.88 HAO1 (0.48) KMOHAO1XDHSLC22A12
SCHEMBL21296936 0.88 HAO1 (0.48) KMOHAO1XDHSLC22A12
SCHEMBL29799085 0.87 HAO1 (0.44) HAO1
SCHEMBL21296859 0.87 HAO1 (0.44) HAO1
SCHEMBL21296934 0.87 RXRA (0.46) BCL2L1MCL1HAO1XDHSLC22A12
SCHEMBL29799196 0.87 RXRA (0.46) BCL2L1MCL1HAO1XDHSLC22A12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11389456-B2 Compounds and methods for treating oxalate-related diseases OXALURX, INC. (US) 2022-07-19 US disclosed
US-20200390778-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. 2020-12-17 US disclosed
US-20200390778-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. 2020-12-17 US disclosed
WO-2019165159-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. (US) 2019-08-29 WO disclosed
WO-2019165159-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. (US) 2019-08-29 WO 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 (2 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-20200390778-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES XDH, PNPO, LOX KMO 459/4885BCL2L1 3005/4885MCL1 3573/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX KMO 459/4885BCL2L1 3005/4885MCL1 3573/4885

“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.