SCHEMBL21296858

SCHEMBL21296858

O=C(O)c1nn[nH]c1Oc1ccc(-c2ccccc2)nc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
LDHA P00338 2/20 0.46
LTA4H P09960 1/20 0.39
CYP4F2 P78329 7/20 0.39
CYP4A11 Q02928 7/20 0.39
HAO1 Q9UJM8 3/20 0.39
TP53 P04637 1/20 0.38
HPGDS O60760 1/20 0.38
BAZ2B Q9UIF8 1/20 0.38
DGAT1 O75907 1/20 0.36

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
SCHEMBL29799083 1.00 CYP11B1 (0.47) CYP11B1CYP11B2LDHALTA4HCYP4F2
SCHEMBL23319886 0.86 HAO1 (0.41) CYP4F2CYP4A11HAO1
SCHEMBL23319901 0.85 MAP4K4 (0.39) CYP11B1CYP11B2CYP4F2CYP4A11HPGDS
SCHEMBL25464994 0.84 CYP4F2 (0.37) CYP11B1CYP11B2CYP4F2CYP4A11HAO1
SCHEMBL25464175 0.84 CYP4F2 (0.37) CYP11B1CYP11B2CYP4F2CYP4A11HAO1
SCHEMBL21296854 0.84 HAO1 (0.44) HAO1TP53HPGDS
SCHEMBL21296849 0.84 TACR3 (0.44) HAO1TP53HPGDS
SCHEMBL29799073 0.84 TACR3 (0.44) HAO1TP53HPGDS
SCHEMBL25463526 0.83 HAO1 (0.34) CYP11B2CYP4F2CYP4A11HAO1HPGDS
SCHEMBL21296882 0.80 HAO1 (0.44) HAO1HPGDS

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 CYP11B1 856/4885CYP11B2 883/4885LDHA 490/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX CYP11B1 856/4885CYP11B2 883/4885LDHA 490/4885

“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.