SCHEMBL25320652

SCHEMBL25320652

Cc1ccc(S(=O)(=O)OCCCC(C)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
CA2 P00918 13/20 0.44
CA1 P00915 9/20 0.44
CA9 Q16790 6/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
CA12 O43570 5/20 0.41
PSMD10 O75832 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
STAT3 P40763 1/20 0.38
P2RX7 Q99572 2/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
HSP90AA1 P07900 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
XBP1 P17861 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL25320649 1.00 ALDH1A1 (0.46) ALDH1A1TSHRCA2CA1CA9
SCHEMBL18205350 0.97 ALDH1A1 (0.48) ALDH1A1TSHRCA2CA1CA9
SCHEMBL4342914 0.93 CA2 (0.46) ALDH1A1TSHRCA2CA1CA9
SCHEMBL27041695 0.86 ALDH1A1 (0.62) ALDH1A1TSHRPPARGPPARAP2RX7
SCHEMBL27041698 0.86 ALDH1A1 (0.62) ALDH1A1TSHRPPARGPPARAP2RX7
SCHEMBL30759533 0.86 ALDH1A1 (0.52) ALDH1A1TSHRCA2CA1CA9
SCHEMBL8235686 0.85 CA2 (0.47) ALDH1A1TSHRCA2CA1CA9
SCHEMBL2545093 0.85 CA2 (0.47) ALDH1A1TSHRCA2CA1CA9
SCHEMBL2545096 0.85 CA2 (0.47) ALDH1A1TSHRCA2CA1CA9
SCHEMBL25436710 0.85 MMP13 (0.40) ALDH1A1TSHRCA2CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260109732-A1 LIPID AMINES MODERNATX INC (US) 2026-04-23 US disclosed
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
EP-4423107-A1 LIPID AMINES ModernaTX, Inc. (US) 2024-09-04 EP disclosed
US-20230365529-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2023-11-16 US disclosed
US-20230365529-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2023-11-16 US 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
WO-2023147418-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2023-08-03 WO disclosed
WO-2023076598-A1 LIPID AMINES MODERNATX, INC. (US) 2023-05-04 WO disclosed
WO-2023076598-A1 LIPID AMINES MODERNATX, INC. (US) 2023-05-04 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 (3 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 ALDH1A1 1171/4885TSHR 4640/4885CA2 3900/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 ALDH1A1 1171/4885TSHR 4640/4885CA2 3900/4885
US-20260109732-A1 LIPID AMINES LDLR, NPC1, PHOSPHO1 ALDH1A1 898/4885TSHR 224/4885CA2 3992/4885

“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.