SCHEMBL24967971

SCHEMBL24967971

C[C@@H]1CN(c2ncc(C(F)(F)F)cn2)C[C@@H](C)N1C(=O)OCCc1c[nH]c(=O)c(C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TIPARP Q7Z3E1 11/20 0.42
CHRM2 P08172 5/20 0.40
CHRM1 P11229 5/20 0.40
CHRM4 P08173 3/20 0.36
CHRM3 P20309 2/20 0.36
HSD11B1 P28845 1/20 0.34

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
SCHEMBL24968344 1.00 TIPARP (0.42) TIPARPCHRM2CHRM1CHRM4CHRM3
SCHEMBL24968356 1.00 TIPARP (0.42) TIPARPCHRM2CHRM1CHRM4CHRM3
SCHEMBL24968343 1.00 TIPARP (0.42) TIPARPCHRM2CHRM1CHRM4CHRM3
SCHEMBL24968349 0.93 WDR5 (0.37) TIPARPCHRM2CHRM1
SCHEMBL24968347 0.93 WDR5 (0.37) TIPARPCHRM2CHRM1
SCHEMBL24968235 0.93 WDR5 (0.37) TIPARPCHRM2CHRM1
SCHEMBL24968241 0.91 ACACB (0.35) TIPARPCHRM2CHRM1CHRM4
SCHEMBL24968240 0.91 ACACB (0.35) TIPARPCHRM2CHRM1CHRM4
SCHEMBL24968457 0.91 ACACB (0.35) TIPARPCHRM2CHRM1CHRM4
SCHEMBL27233753 0.90 GPR119 (0.40) TIPARPCHRM2CHRM1

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-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
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 TIPARP 142/4885CHRM2 4881/4885CHRM1 4884/4885

“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.