SCHEMBL8580952

SCHEMBL8580952

COC(=O)c1cc(S(C)(=O)=O)c(C)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
MAP3K5 Q99683 1/20 0.44
KDM4E B2RXH2 4/20 0.44
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL8581591 0.86 CA2 (0.51) GAAMAP3K5KDM4EHTTNPSR1
SCHEMBL7801323 0.85 KDM4E (0.54) MAP3K5KDM4ENPSR1KMT2AHSD17B10
SCHEMBL8580625 0.85 SLC9A1 (0.45) KDM4EHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL14871092 0.84 GAA (0.44) GAAKDM4EHTTNPSR1MEN1
SCHEMBL8574362 0.83 GAA (0.56) GAAKDM4EHTTNPSR1MEN1
SCHEMBL8582018 0.81 SLC9A1 (0.45) GAAKDM4EHTTNPSR1MEN1
SCHEMBL8581653 0.81 HTT (0.45) GAAKDM4EHTTNPSR1MEN1
SCHEMBL8573449 0.81 CA2 (0.41) KDM4ENPSR1KMT2AHSD17B10SMN1; SMN2
SCHEMBL8581950 0.81 ALDH1A1 (0.40) KDM4EHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL8573417 0.80 GAA (0.43) GAAKDM4EHTTNPSR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230054028-A1 PD-L1 ANTAGONIST COMPOUND ADLAI NORTYE BIOPHARMA CO., LTD. (CN) 2023-02-23 US disclosed
EP-4083032-A1 PD-L1 ANTAGONIST COMPOUND Adlai Nortye Biopharma Co., Ltd. (CN) 2022-11-02 EP disclosed
WO-2021129584-A1 PD-L1 ANTAGONIST COMPOUND 杭州阿诺生物医药科技有限公司 2021-07-01 WO disclosed
US-5840761-A Alkylbenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-11-24 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 (1 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-20230054028-A1 PD-L1 ANTAGONIST COMPOUND CD274, PDCD1LG2, PDCD1 GAA 1336/4885MAP3K5 503/4885KDM4E 1659/4885

“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.