SCHEMBL24968933

SCHEMBL24968933

COC(=O)CCO[C@H]1CCC[C@@H]1c1cnc(OC)c(C(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 7/20 0.34
PIK3CA P42336 5/20 0.34
KCNK3 O14649 1/20 0.34
SSTR4 P31391 2/20 0.33
RIPK1 Q13546 5/20 0.33
PIK3CB P42338 2/20 0.33
HTR2B P41595 1/20 0.33
PIK3CG P48736 1/20 0.33
PRKDC P78527 1/20 0.33
PDE4D Q08499 1/20 0.33
PIK3R1 P27986 1/20 0.33
CFTR P13569 3/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL24968341 1.00 PIK3CD (0.34) PIK3CDPIK3CAKCNK3SSTR4RIPK1
SCHEMBL24968338 0.91 PIK3CD (0.35) PIK3CDPIK3CAKCNK3SSTR4RIPK1
SCHEMBL27233855 0.91 PIK3CD (0.35) PIK3CDPIK3CAKCNK3SSTR4RIPK1
SCHEMBL24968934 0.91 PIK3CD (0.35) PIK3CDPIK3CAKCNK3SSTR4RIPK1
SCHEMBL24968383 0.85 TACR1 (0.35) PIK3CDPIK3CAKCNK3SSTR4RIPK1
SCHEMBL24968385 0.83 CYP11B1 (0.36) PIK3CDPIK3CAKCNK3SSTR4RIPK1
SCHEMBL24968342 0.82 HCRTR1 (0.36) PIK3CAPIK3R1CFTR
SCHEMBL27233713 0.80 TIPARP (0.47)
SCHEMBL24968213 0.78 SLC6A2 (0.44) PIK3CDPIK3CAKCNK3SSTR4RIPK1
SCHEMBL24968932 0.76 AR (0.45) PIK3CDPIK3CAPIK3CBPIK3R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240351997-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF SHANGHAI QILU PHARMACEUTICAL RESEARCH AND DEVELOPMENT CENTRE LTD. (CN) 2024-10-24 US disclosed
EP-4378938-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2024-06-05 EP disclosed
WO-2023006013-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF 上海齐鲁制药研究中心有限公司 2023-02-02 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 (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-20240351997-A1 NOVEL PARP7 INHIBITOR AND USE THEREOF PARP6, PARP4, PARP3 PIK3CD 753/4885PIK3CA 585/4885KCNK3 3292/4885

“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.