SCHEMBL21296946

SCHEMBL21296946

Oc1ccc(-c2cc(Cl)cc(Cl)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.65
ABL1 P00519 3/20 0.59
ABCB1 P08183 3/20 0.59
BCR P11274 3/20 0.59
ESR2 Q92731 7/20 0.58
RXRA P19793 1/20 0.56
RXRB P28702 1/20 0.56
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ALOX5 P09917 2/20 0.48
MMP3 P08254 1/20 0.48
BCL2L1 Q07817 1/20 0.48
KDM1A O60341 1/20 0.47
HSD17B1 P14061 1/20 0.46
HSD17B2 P37059 1/20 0.46

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
SCHEMBL28973449 0.86 MMP3 (0.65) ESR1ABL1ABCB1BCRESR2
SCHEMBL1958364 0.86 RXRA (0.61) ESR1RXRARXRBALOX5KDM1A
SCHEMBL4246853 0.80 AHR (0.62) RXRARXRBALOX5
SCHEMBL1022492 0.80 ESR1 (0.69) ESR1ABL1ABCB1BCRESR2
SCHEMBL24617945 0.80 ESR1 (1.00) ESR1ABL1ABCB1BCRESR2
SCHEMBL920655 0.80 ESR1 (1.00) ESR1ABL1ABCB1BCRESR2
SCHEMBL187833 0.80 ESR1 (1.00) ESR1ABL1ABCB1BCRESR2
SCHEMBL29434858 0.78 ESR1 (0.70) ESR1ABL1ABCB1BCRESR2
SCHEMBL5379998 0.78 ESR1 (0.70) ESR1ABL1ABCB1BCRESR2
SCHEMBL10539436 0.77 AHR (0.65) ESR1ABL1ABCB1BCRESR2

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 4 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
CN-111518044-A Alkoxy isoxazole derivative and preparation method and application thereof 华东师范大学 2020-08-11 CN 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 ESR1 4780/4885ABL1 3986/4885ABCB1 2152/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX ESR1 4780/4885ABL1 3986/4885ABCB1 2152/4885

“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.