SCHEMBL25205759

SCHEMBL25205759

CCOC(=O)c1sc2cc(F)cc(F)c2c1N

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.68
KDM4E B2RXH2 10/20 0.68
HPGD P15428 8/20 0.68
HSD17B10 Q99714 6/20 0.68
GAA P10253 4/20 0.68
GLA P06280 3/20 0.68
TSHR P16473 3/20 0.68
MAPK1 P28482 3/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
MAPT P10636 12/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
CASP1 P29466 1/20 0.51
CASP7 P55210 1/20 0.51
ATM Q13315 1/20 0.51
NPC1 O15118 5/20 0.48
RAB9A P51151 5/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
GPR55 Q9Y2T6 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL31015990 1.00 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL31015927 0.84 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL31015917 0.84 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL25204538 0.84 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL25223134 0.79 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL19212281 0.74 KDM4E (0.59) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL23635880 0.74 STING1 (0.44) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL19212025 0.74 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL25232875 0.74 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL14586047 0.73 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10GAA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12466803-B2 BCKDK inhibitors and/or degraders PFIZER INC. (US) 2025-11-11 US disclosed
WO-2023100061-A1 3-PHENYL-1-BENZOTHIOPHENE-2-CARBOXYLIC ACID DERIVATIVES AS BRANCHED-CHAIN ALPHA KETO ACID DEHYDROGENASE KINASE INHIBITORS FOR THE TREATMENT OF DIABETES, KIDNEY DISEASES, NASH AND HEART FAILURE PFIZER INC. (US) 2023-06-08 WO disclosed
WO-2023100061-A1 3-PHENYL-1-BENZOTHIOPHENE-2-CARBOXYLIC ACID DERIVATIVES AS BRANCHED-CHAIN ALPHA KETO ACID DEHYDROGENASE KINASE INHIBITORS FOR THE TREATMENT OF DIABETES, KIDNEY DISEASES, NASH AND HEART FAILURE PFIZER INC. (US) 2023-06-08 WO disclosed
US-20230167080-A1 BCKDK INHIBITORS AND/OR DEGRADERS PFIZER INC. (US) 2023-06-01 US disclosed
US-20230167080-A1 BCKDK INHIBITORS AND/OR DEGRADERS PFIZER INC. (US) 2023-06-01 US disclosed
US-20230167080-A1 BCKDK INHIBITORS AND/OR DEGRADERS PFIZER INC. (US) 2023-06-01 US 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-12466803-B2 BCKDK inhibitors and/or degraders BCKDK, KHK, PDK4 ALDH1A1 468/4885KDM4E 670/4885HPGD 465/4885
US-20230167080-A1 BCKDK INHIBITORS AND/OR DEGRADERS BCKDK, KHK, PDK4 ALDH1A1 468/4885KDM4E 670/4885HPGD 465/4885

“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.