SCHEMBL21296953

SCHEMBL21296953

Cc1ccc(-c2cccc(Oc3[nH]nnc3C(=O)O)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.47
DHODH Q02127 2/20 0.42
MAPT P10636 2/20 0.42
PIN1 Q13526 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
RXRA P19793 2/20 0.41
RXRB P28702 2/20 0.41
HAO2 Q9NYQ3 1/20 0.41
P2RX3 P56373 1/20 0.40
XDH P47989 1/20 0.40
SLC22A12 Q96S37 1/20 0.40
ALPL P05186 1/20 0.40
HAO1 Q9UJM8 4/20 0.39

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
SCHEMBL29799187 1.00 FFAR4 (0.47) FFAR4DHODHMAPTPIN1CYP1A2
SCHEMBL29799085 0.91 HAO1 (0.44) FFAR4DHODHPIN1RXRARXRB
SCHEMBL21296859 0.91 HAO1 (0.44) FFAR4DHODHPIN1RXRARXRB
SCHEMBL21296954 0.89 PRKAG1 (0.50) FFAR4DHODHMAPTPIN1XDH
SCHEMBL29799086 0.89 PRKAG1 (0.50) FFAR4DHODHMAPTPIN1XDH
SCHEMBL21296979 0.88 HAO1 (0.47) FFAR4RXRARXRBXDHSLC22A12
SCHEMBL29799238 0.88 HAO1 (0.47) FFAR4RXRARXRBXDHSLC22A12
SCHEMBL21296970 0.87 ALPL (0.42) FFAR4DHODHMAPTXDHALPL
SCHEMBL24154725 0.87 RXRA (0.44) DHODHPIN1RXRARXRBHAO2
SCHEMBL21296929 0.87 PIN1 (0.49) FFAR4DHODHMAPTPIN1XDH

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 FFAR4 4014/4885DHODH 140/4885MAPT 1559/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX FFAR4 4014/4885DHODH 140/4885MAPT 1559/4885

“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.