SCHEMBL25436710

SCHEMBL25436710

Cc1ccc(S(=O)(=O)OCCCC2CCN2C(=O)OC(C)(C)C)cc1.Cc1ccc(S(=O)(=O)OCCC[C@H](C)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.40
GPR119 Q8TDV5 8/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
P2RX7 Q99572 2/20 0.37
CYP3A4 P08684 1/20 0.35
MCL1 Q07820 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL25319775 0.88 GPR119 (0.47) MMP13GPR119MEN1KMT2A
SCHEMBL25320649 0.85 ALDH1A1 (0.46) ALDH1A1TSHRP2RX7CA1CA2
SCHEMBL25320652 0.85 ALDH1A1 (0.46) ALDH1A1TSHRP2RX7CA1CA2
SCHEMBL16538611 0.83 GPR119 (0.45) MMP13GPR119MEN1KMT2A
SCHEMBL16538625 0.83 GPR119 (0.45) MMP13GPR119MEN1KMT2A
SCHEMBL7414916 0.82 GPR119 (0.43) MMP13GPR119MEN1KMT2A
SCHEMBL7414912 0.82 GPR119 (0.43) MMP13GPR119MEN1KMT2A
SCHEMBL18205350 0.82 ALDH1A1 (0.48) ALDH1A1TSHRP2RX7CA1CA2
SCHEMBL4342914 0.79 CA2 (0.46) MMP13MEN1KMT2AALDH1A1TSHR
SCHEMBL29285446 0.78 LMNA (0.45) MMP13GPR119MEN1KMT2A

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-12459922-B2 PARP7 inhibitors GILEAD SCIENCES, INC. (US) 2025-11-04 US disclosed
EP-4469448-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2024-12-04 EP disclosed
US-20230365529-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2023-11-16 US disclosed
WO-2023147418-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2023-08-03 WO 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-12459922-B2 PARP7 inhibitors PARP1, PARP11, PARP2 MMP13 1909/4885GPR119 2478/4885MEN1 1485/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 MMP13 1909/4885GPR119 2478/4885MEN1 1485/4885

“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.