SCHEMBL24967933

SCHEMBL24967933

O=C(Cc1cccc(-c2c[nH]c(=O)c(C(F)(F)F)c2)c1)N1CCN(c2ncc(C(F)(F)F)cn2)CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TIPARP Q7Z3E1 14/20 0.54
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
SLC6A7 Q99884 1/20 0.42
PARP1 P09874 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41

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
SCHEMBL24968208 0.86 TIPARP (0.59) TIPARP
SCHEMBL30164987 0.82 TRPA1 (0.54) TIPARPMAPTSLC6A7NPSR1
SCHEMBL24967938 0.82 TRPA1 (0.54) TIPARPMAPTSLC6A7NPSR1
SCHEMBL24967932 0.82 PIK3CD (0.48) TIPARPMEN1KMT2APOLBMAPT
SCHEMBL30165044 0.82 PIK3CD (0.48) TIPARPMEN1KMT2APOLBMAPT
SCHEMBL24968189 0.79 TIPARP (0.65) TIPARPPARP1CYP2C9
SCHEMBL30165098 0.77 TIPARP (0.75) TIPARPSLC6A7PARP1
SCHEMBL24968300 0.77 TIPARP (0.75) TIPARPSLC6A7PARP1
SCHEMBL27233733 0.77 TIPARP (0.68) TIPARPPARP1CYP2C9
SCHEMBL24968171 0.76 TIPARP (0.66) TIPARPPARP1CYP2C9

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
CN-117642393-A Novel PARP7 inhibitor and application thereof 上海齐鲁制药研究中心有限公司 2024-03-01 CN 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 142/4885MEN1 2207/4885KMT2A 1024/4885

“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.