SCHEMBL25210508

SCHEMBL25210508

Fc1cc2c(c(F)c1Br)CCCO2

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
ACHE P22303 1/20 0.31
HTR1A P08908 1/20 0.30
HTR1D P28221 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL31204901 0.76 LMNA (0.35) SMN1; SMN2ACHEHTR1AHTR1DHTR2A
SCHEMBL25211126 0.75 CTNNB1 (0.30)
SCHEMBL31015972 0.75 CTNNB1 (0.30)
SCHEMBL25208990 0.73 HTR2C (0.36) EGFRSMN1; SMN2ACHEHTR1AHTR1D
SCHEMBL22899859 0.73 HTR2C (0.39) EGFRACHEHTR1AHTR1DHTR2A
SCHEMBL24599488 0.72 HTR2A (0.35) ACHEHTR1AHTR1DHTR2AHTR2C
SCHEMBL29809660 0.72 HTR2A (0.35) ACHEHTR1AHTR1DHTR2AHTR2C
SCHEMBL4920199 0.71 PARP1 (0.33) HTR1A
SCHEMBL14576619 0.69 CTNNB1 (0.38) SMN1; SMN2HTR1DHTR2C
SCHEMBL23648258 0.68 CA1 (0.30)

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-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
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 EGFR 833/4885SMN1; SMN2 3687/4885ACHE 4476/4885
US-20230167080-A1 BCKDK INHIBITORS AND/OR DEGRADERS BCKDK, KHK, PDK4 EGFR 833/4885SMN1; SMN2 3687/4885ACHE 4476/4885

“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.