SCHEMBL26123760

SCHEMBL26123760

O=C(O)CC1CCN(c2nccs2)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.55
HPGD P15428 1/20 0.53
ALDH1A1 P00352 1/20 0.50
HTT P42858 1/20 0.49
HRH3 Q9Y5N1 1/20 0.47
GRM5 P41594 1/20 0.47
GRM1 Q13255 1/20 0.47
SLC6A7 Q99884 1/20 0.46
EPHX2 P34913 1/20 0.43
DRD2 P14416 1/20 0.42
FFAR4 Q5NUL3 3/20 0.42
MEN1 O00255 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
SCD O00767 1/20 0.41
PDE4B Q07343 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
SCHEMBL1025896 0.92 HSD17B10 (0.50) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL28982953 0.87 HPGD (0.52) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL4358945 0.85 KDM4C (0.47) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL26127791 0.83 HPGD (0.52) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL1700773 0.81 HPGD (0.51) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL1994252 0.80 HSD17B10 (0.67) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL1729839 0.80 HSD17B10 (0.53) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL1668959 0.79 HSD17B10 (0.65) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL6029924 0.78 MEN1 (0.49) HSD17B10HPGDALDH1A1HTTHRH3
SCHEMBL11996777 0.78 HPGD (0.59) HSD17B10HPGDALDH1A1HTTHRH3

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-20240336596-A1 PARP7 INHIBITOR AND USE THEREOF NOVOSTAR PHARMACEUTICALS, LTD. (CN) 2024-10-10 US disclosed
CN-115785074-B PARP7 inhibitors and uses thereof 诺沃斯达药业(上海)有限公司 2024-05-07 CN disclosed
EP-4338737-A1 PARP7 INHIBITOR AND USE THEREOF Novostar Pharmaceuticals, Ltd. (CN) 2024-03-20 EP disclosed
WO-2023185073-A1 PARP7 INHIBITOR AND USE THEREOF 诺沃斯达药业(上海)有限公司 2023-10-05 WO disclosed
WO-2023185073-A1 PARP7 INHIBITOR AND USE THEREOF 诺沃斯达药业(上海)有限公司 2023-10-05 WO disclosed
CN-115785074-A PARP7 inhibitors and uses thereof 诺沃斯达药业(上海)有限公司 2023-03-14 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 (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-20240336596-A1 PARP7 INHIBITOR AND USE THEREOF PARP1, PARP3, PARP11 HSD17B10 508/4885HPGD 335/4885ALDH1A1 647/4885

“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.