SCHEMBL26125507

SCHEMBL26125507

O=C(O)CN1C2CC1CN(c1ncc(C(F)(F)F)cn1)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TIPARP Q7Z3E1 1/20 0.43
▸ ACACB O00763 1/20 0.42
▸ CHRM2 P08172 3/20 0.39
▸ CHRM1 P11229 2/20 0.39
▸ RBP4 P02753 1/20 0.39
▸ HDAC3 O15379 3/20 0.39
▸ HDAC4 P56524 3/20 0.39
▸ HDAC1 Q13547 3/20 0.39
▸ HDAC7 Q8WUI4 3/20 0.39
▸ HDAC2 Q92769 3/20 0.39
▸ HDAC10 Q969S8 3/20 0.39
▸ HDAC11 Q96DB2 3/20 0.39
▸ HDAC8 Q9BY41 3/20 0.39
▸ HDAC6 Q9UBN7 3/20 0.39
▸ HDAC9 Q9UKV0 3/20 0.39
▸ HDAC5 Q9UQL6 3/20 0.39
▸ SLC6A9 P48067 8/20 0.39
▸ MDM2 Q00987 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ PPARD Q03181 1/20 0.38

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
SCHEMBL26125453 0.92 ACACB (0.42) TIPARPACACBCHRM2CHRM1HDAC3
SCHEMBL30286299 0.88 TIPARP (0.42) TIPARPACACBCHRM2HDAC3HDAC4
SCHEMBL26125223 0.83 HPGD (0.42) TIPARPACACBCHRM2SLC6A9PPARG
SCHEMBL27173051 0.82 TIPARP (0.47) TIPARPACACBCHRM2CHRM1RBP4
SCHEMBL30286308 0.81 ACACB (0.42) TIPARPACACBCHRM2CHRM1SLC6A9
SCHEMBL26122829 0.78 ACACB (0.43) TIPARPACACBCHRM2CHRM1HDAC3
SCHEMBL26124699 0.78 ACACB (0.46) ACACBCHRM2CHRM1RBP4HDAC3
SCHEMBL30286395 0.77 ACACB (0.45) TIPARPACACBCHRM2CHRM1HDAC3
SCHEMBL26124703 0.76 HPGD (0.42) ACACBSLC6A9PPARGPPARDPPARA
SCHEMBL16433993 0.76 NOTUM (0.49) ACACBCHRM2CHRM1RBP4HDAC3

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 5 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
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 TIPARP 54/4885ACACB 2059/4885CHRM2 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.

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