SCHEMBL21296901

SCHEMBL21296901

O=C(O)c1nn[nH]c1Sc1ccccc1F

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 3/20 0.38
NOTUM Q6P988 1/20 0.36
TTR P02766 1/20 0.35
HCAR3 P49019 1/20 0.34
LDHA P00338 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GCK P35557 1/20 0.32
POLB P06746 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL29799106 1.00 HAO1 (0.38) HAO1NOTUMTTRHCAR3LDHA
SCHEMBL21296875 0.82 PKM (0.46) HAO1NOTUMLDHAHCAR2ALDH1A1
SCHEMBL21296937 0.82 HAO1 (0.38) HAO1NOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL29799229 0.82 PKM (0.46) HAO1NOTUMLDHAHCAR2ALDH1A1
SCHEMBL21296980 0.80 KDM4E (0.43) KDM4EALDH1A1MAPTPOLB
SCHEMBL21312823 0.80 ALDH1A1 (0.37) HAO1HCAR2KDM4EALDH1A1MAPT
SCHEMBL29799188 0.79 HAO1 (0.42) HAO1MAPTPOLB
SCHEMBL21296904 0.79 HAO1 (0.42) HAO1MAPTPOLB
SCHEMBL21312725 0.79 DHODH (0.40) TTRALDH1A1MAPTL3MBTL1
SCHEMBL21312771 0.76 ALDH1A1 (0.48) HCAR3KDM4EALDH1A1SMN1; SMN2L3MBTL1

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 14/4885NOTUM 1065/4885TTR 1906/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX HAO1 14/4885NOTUM 1065/4885TTR 1906/4885

“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.