SCHEMBL25037576

SCHEMBL25037576

COc1cc(N)c(C(=O)OCC[Si](C)(C)C)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.59
KMT2A Q03164 2/20 0.53
CYP3A4 P08684 3/20 0.45
HTR4 Q13639 3/20 0.45
CYP2D6 P10635 2/20 0.45
HTR3A P46098 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GLA P06280 1/20 0.43
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL25039211 0.81 MCHR1 (0.44) KDM4EKMT2ASMN1; SMN2ALDH1A1
SCHEMBL28944986 0.81 MCHR1 (0.44) KDM4EKMT2ASMN1; SMN2ALDH1A1
SCHEMBL3373962 0.80 KDM4E (0.69) KDM4EKMT2ACYP3A4HTR4CYP2D6
SCHEMBL25037577 0.79 KDM4E (0.59) KDM4EKMT2ACYP3A4HTR4CYP2D6
SCHEMBL25039191 0.78 KDM4E (0.58) KDM4EKMT2ACYP3A4HTR4CYP2D6
SCHEMBL28788888 0.78 KMT2A (0.56) KMT2ACYP3A4MEN1ALDH1A1
SCHEMBL18373610 0.77 KDM4E (0.56) KDM4EKMT2ACYP3A4HTR4CYP2D6
SCHEMBL6164950 0.77 ALDH1A1 (0.43) KDM4EKMT2ACYP3A4HTR3ATSHR
SCHEMBL11404760 0.76 KDM4E (0.79) KDM4EKMT2ACYP3A4TSHRGLA
SCHEMBL31408659 0.76 KDM4E (1.00) KDM4EKMT2ATSHRGLAALDH1A1

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-12605353-B2 PDIA4 inhibitors and use thereof for inhibiting β-cell pathogenesis and treating diabetes ACADEMIA SINICA (TW) 2026-04-21 US disclosed
EP-4069252-B1 PDIA4 INHIBITORS AND USE THEREOF FOR INHIBITING SS-CELL PATHOGENESIS AND TREATING DIABETES ACADEMIA SINICA (CN) 2025-12-10 EP disclosed
CN-114761025-B PDIA4 inhibitors and their use for inhibiting beta cell pathologies and for treating diabetes 施明哲 2024-03-12 CN disclosed
US-20230046445-A1 PDIA4 INHIBITORS AND USE THEREOF FOR INHIBITING ß-CELL PATHOGENESIS AND TREATING DIABETES ACADEMIA SINICA (TW) 2023-02-16 US disclosed
US-20230046445-A1 PDIA4 INHIBITORS AND USE THEREOF FOR INHIBITING ß-CELL PATHOGENESIS AND TREATING DIABETES ACADEMIA SINICA (TW) 2023-02-16 US disclosed
CN-114761025-A PDIA4 inhibitor and application thereof in inhibiting beta cell pathology and treating diabetes 施明哲 2022-07-15 CN 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-12605353-B2 PDIA4 inhibitors and use thereof for inhibiting β-cell pathogenesis and treating diabetes PDIA4, PDIA5, PDIA6 KDM4E 2024/4885KMT2A 4291/4885CYP3A4 712/4885
US-20230046445-A1 PDIA4 INHIBITORS AND USE THEREOF FOR INHIBITING ß-CELL PATHOGENESIS AND TREATING DIABETES PDIA4, PDIA6, PDIA5 KDM4E 1437/4885KMT2A 3652/4885CYP3A4 216/4885

“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.