SCHEMBL21296872

SCHEMBL21296872

O=C(O)c1nn[nH]c1Oc1ccc(-c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 3/20 0.44
KMO O15229 11/20 0.43
XDH P47989 2/20 0.42
PRKAG1 P54619 2/20 0.39
PRKAA1 Q13131 2/20 0.39
PRKAB1 Q9Y478 2/20 0.39
PRKAB2 O43741 1/20 0.38
PRKAA2 P54646 1/20 0.38
PRKAG3 Q9UGI9 1/20 0.38
PRKAG2 Q9UGJ0 1/20 0.38
PTPN2 P17706 1/20 0.38
PTPN1 P18031 1/20 0.38
BCL2L1 Q07817 1/20 0.38
MCL1 Q07820 1/20 0.38

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
SCHEMBL21296869 0.89 KMO (0.48) HAO1KMO
SCHEMBL29799135 0.89 KMO (0.48) HAO1KMO
SCHEMBL21296850 0.89 KMO (0.44) HAO1KMOXDHBCL2L1MCL1
SCHEMBL24154378 0.89 KMO (0.41) HAO1KMOXDHPRKAG1PRKAA1
SCHEMBL29799107 0.89 KMO (0.44) HAO1KMOXDHBCL2L1MCL1
SCHEMBL21296963 0.87 HAO1 (0.49) HAO1XDH
SCHEMBL21296913 0.86 RXRA (0.45) HAO1XDHPRKAG1PRKAA1PRKAB1
SCHEMBL21312624 0.85 HAO1 (0.47) HAO1KMOXDHPRKAG1PRKAA1
SCHEMBL21296854 0.84 HAO1 (0.44) HAO1PRKAG1PRKAA1PRKAB1MCL1
SCHEMBL23319926 0.83 HAO1 (0.39) HAO1PRKAG1PRKAA1PRKAB1PRKAB2

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 HAO1 14/4885KMO 459/4885XDH 1/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX HAO1 14/4885KMO 459/4885XDH 1/4885

“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.