SCHEMBL23564892

SCHEMBL23564892

CCOC(=O)c1c2c(nn1COCC[Si](C)(C)C)C[C@]1(C)[C@H](C2)[C@@H]1C

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.34
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 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
SCHEMBL24534978 0.84 DGAT1 (0.35) DGAT1
SCHEMBL23564893 0.83 DGAT1 (0.33) DGAT1ALDH1A1
SCHEMBL23525109 0.72
SCHEMBL6892470 0.71 ADORA1 (0.38) DGAT1KDM4EALDH1A1HPGD
SCHEMBL30975943 0.70 DGAT1 (0.35) DGAT1
SCHEMBL31412670 0.69 DGAT1 (0.36) DGAT1KDM4EALDH1A1HPGD
SCHEMBL24534977 0.69 DGAT1 (0.33) DGAT1ALDH1A1
SCHEMBL24906231 0.69 DGAT1 (0.39) DGAT1ALDH1A1HPGD
SCHEMBL30975918 0.69 DGAT1 (0.35) DGAT1KDM4EALDH1A1HPGD
SCHEMBL23567652 0.68 AURKA (0.38) KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661419-B2 Benzimidazole derivative compounds and uses thereof PFIZER INC. (US) 2023-05-30 US disclosed
WO-2022130175-A1 PYRIDO[2,3-D]IMIDAZOLE DERIVATIVES AND THEIR USE AS INHIBITORS OF ITK FOR THE TEATMENT OF SKIN DISEASE PFIZER INC. (US) 2022-06-23 WO disclosed
US-20210188829-A1 Chemical Compounds PFIZER INC. (US) 2021-06-24 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-11661419-B2 Benzimidazole derivative compounds and uses thereof ITK, HRH4, BLK DGAT1 4107/4885KDM4E 1222/4885ALDH1A1 242/4885
US-20210188829-A1 Chemical Compounds ITK, HRH4, HRH1 DGAT1 3972/4885KDM4E 1327/4885ALDH1A1 167/4885

“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.