SCHEMBL21296897

SCHEMBL21296897

CCCC(C)c1ccc(Oc2[nH]nnc2C(=O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 9/20 0.41
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
HCAR3 P49019 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
FFAR1 O14842 1/20 0.34
ACACA Q13085 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL21296938 0.86 HAO1 (0.42) HAO1ALDH1A1MEN1KMT2A
SCHEMBL29799077 0.86 HAO1 (0.42) HAO1ALDH1A1MEN1KMT2A
SCHEMBL21296983 0.84 HAO1 (0.41) HAO1ALDH1A1NPC1RAB9AMEN1
SCHEMBL21296877 0.84 HAO1 (0.39) HAO1ALDH1A1TSHRFFAR1
SCHEMBL23319926 0.81 HAO1 (0.39) HAO1NPC1RAB9AACACA
SCHEMBL21296966 0.79 ALPL (0.43) HAO1ALDH1A1NPC1RAB9AKMT2A
SCHEMBL21312436 0.79 ALPL (0.49) HAO1ALDH1A1NPC1RAB9AMEN1
SCHEMBL21296977 0.79 PTGS2 (0.40) HAO1TSHRACACA
SCHEMBL21312442 0.77 GAA (0.45) HAO1MEN1KMT2ATDP1
SCHEMBL21296956 0.77 HAO1 (0.52) HAO1

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 14/4885ALDH1A1 543/4885TSHR 4459/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX HAO1 14/4885ALDH1A1 543/4885TSHR 4459/4885

“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.