SCHEMBL21296966

SCHEMBL21296966

CCc1ccc(Oc2[nH]nnc2C(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALPL P05186 2/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
HAO1 Q9UJM8 8/20 0.41
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAOB P27338 1/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 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
SCHEMBL21312436 0.86 ALPL (0.49) ALPLHAO1ALDH1A1RAB9ANPC1
SCHEMBL21296977 0.85 PTGS2 (0.40) HAO1
SCHEMBL25465253 0.84 BCL2 (0.52)
SCHEMBL21296942 0.84 ALDH1A1 (0.43) HAO1ALDH1A1NPC1KMT2AKDM4E
SCHEMBL29799129 0.84 ALDH1A1 (0.43) HAO1ALDH1A1NPC1KMT2AKDM4E
SCHEMBL21312442 0.84 GAA (0.45) ALPLHAO1KMT2A
SCHEMBL21296956 0.84 HAO1 (0.52) ALPLCA9HAO1
SCHEMBL21296877 0.82 HAO1 (0.39) HAO1ALDH1A1
SCHEMBL21312622 0.82 ALPL (0.52) ALPLRXRARXRBHAO1ALDH1A1
SCHEMBL24154172 0.82 AKR1C2 (0.40) HAO1PPARGPPARA

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 ALPL 576/4885CA12 843/4885CA9 412/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX ALPL 576/4885CA12 843/4885CA9 412/4885

“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.