SCHEMBL21296862

SCHEMBL21296862

O=C(O)c1nn[nH]c1Oc1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 5/20 0.49
CA12 O43570 1/20 0.42
ALPL P05186 1/20 0.42
RPA1 P27694 1/20 0.42
BCL2L1 Q07817 2/20 0.41
BAD Q92934 1/20 0.41
CHEK2 O96017 1/20 0.41
HAO2 Q9NYQ3 1/20 0.40
SCN9A Q15858 3/20 0.40
SCN4A P35499 2/20 0.40
XDH P47989 1/20 0.39
MCL1 Q07820 1/20 0.37
DHODH Q02127 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
SCHEMBL23319896 0.96 HAO1 (0.52) HAO1CA12ALPLRPA1CHEK2
SCHEMBL23319972 0.94 HAO1 (0.51) HAO1CA12ALPLRPA1CHEK2
SCHEMBL21312672 0.91 HAO1 (0.41) HAO1CA12ALPLRPA1CHEK2
SCHEMBL21296854 0.88 HAO1 (0.44) HAO1MCL1
SCHEMBL23001672 0.88 HAO1 (0.65) HAO1
SCHEMBL21312597 0.87 HAO1 (0.47) HAO1HAO2DHODH
SCHEMBL29799054 0.87 HAO1 (0.47) HAO1HAO2DHODH
SCHEMBL24154487 0.87 HAO1 (0.38) HAO1ALPLSCN9AMCL1
SCHEMBL23319995 0.86 HAO1 (0.46) HAO1ALPL
SCHEMBL23320006 0.86 HAO1 (0.46) HAO1ALPL

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 14/4885CA12 843/4885ALPL 576/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX HAO1 14/4885CA12 843/4885ALPL 576/4885

“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.