SCHEMBL21296903

SCHEMBL21296903

CCOC(=O)c1nn[nH]c1Sc1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
TARBP2 Q15633 1/20 0.44
SLC5A1 P13866 1/20 0.42
SLC5A2 P31639 1/20 0.42
HTT P42858 1/20 0.41
CYP19A1 P11511 2/20 0.41
KDM4E B2RXH2 2/20 0.39
DUSP3 P51452 1/20 0.39
POLB P06746 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA9 Q16790 1/20 0.38
IDO1 P14902 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.37
DHODH Q02127 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ELANE P08246 2/20 0.37
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36

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
SCHEMBL21296915 0.87 ALPL (0.47) MAPTTARBP2HTTCYP19A1KDM4E
SCHEMBL21296967 0.86 NPC1 (0.48) MAPTTARBP2HTTKDM4EPOLB
SCHEMBL23001880 0.85 CYP19A1 (0.43) MAPTCYP19A1KDM4EPOLBNPSR1
SCHEMBL29891693 0.85 CYP19A1 (0.43) MAPTCYP19A1KDM4EPOLBNPSR1
SCHEMBL22816750 0.80 MAPT (0.47) MAPTTARBP2HTTCYP19A1KDM4E
SCHEMBL21296917 0.79 RHEB (0.41) HTTNPSR1
SCHEMBL22815731 0.77 MAPT (0.45) MAPTTARBP2HTTCYP19A1KDM4E
SCHEMBL21312707 0.76 RHEB (0.39) HTTCA1CA2CA4CA9
SCHEMBL21296961 0.75 MAPT (0.45) MAPTTARBP2SLC5A1SLC5A2HTT
SCHEMBL21296944 0.75 MAPT (0.56) MAPTHTTCYP19A1KDM4EPOLB

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 MAPT 1559/4885TARBP2 4682/4885SLC5A1 437/4885
US-11389456-B2 Compounds and methods for treating oxalate-related diseases XDH, PNPO, LOX MAPT 1559/4885TARBP2 4682/4885SLC5A1 437/4885

“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.