SCHEMBL29838176

SCHEMBL29838176

CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)CC)[C@@H](C)O

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 8/20 0.67
▸ NPY4R P50391 8/20 0.67
▸ NPY5R Q15761 8/20 0.67
▸ NPY1R P25929 6/20 0.67
▸ CALCR P30988 3/20 0.62
▸ CRHR1 P34998 1/20 0.62
▸ CRHR2 Q13324 1/20 0.62
▸ GLP1R P43220 4/20 0.61
▸ TFPI P10646 3/20 0.61

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
SCHEMBL31146614 0.92 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30495784 0.91 NPY2R (0.70) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30578732 0.91 NPY2R (0.74) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29360287 0.90 NPY2R (0.71) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30804648 0.90 NPY2R (0.63) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31182717 0.89 CALCR (0.68) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30495665 0.89 CALCR (0.65) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30658400 0.89 NPY2R (0.63) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL31182942 0.89 NPY2R (0.59) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30658245 0.89 CALCR (0.71) NPY2RNPY4RNPY5RNPY1RCALCR

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-11801240-B2 Combination therapies and uses thereof TESARO, INC. (US) 2023-10-31 — — US claimed
US-12297184-B2 Niraparib salts TESARO, INC. (US) 2025-05-13 — — US disclosed
US-20240082231-A1 NIRAPARIB FORMULATIONS TESARO, INC. 2024-03-14 — — US disclosed
US-11801240-B2 Combination therapies and uses thereof TESARO, INC. (US) 2023-10-31 — — US disclosed
US-11730725-B2 Niraparib formulations TESARO, INC. (US) 2023-08-22 — — US disclosed
US-20220249598-A1 COMPOSITIONS TARGETING SPERM CALCINEURIN KENT STATE UNIVERSITY (US) 2022-08-11 — — US 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 (4 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-11801240-B2 Combination therapies and uses thereof PARP2, PARP3, PARP4 NPY2R 3689/4885NPY4R 3387/4885NPY5R 3828/4885
US-12297184-B2 Niraparib salts PARP2, PARP1, TOP2B NPY2R 4214/4885NPY4R 4580/4885NPY5R 3730/4885
US-11730725-B2 Niraparib formulations PARP2, PARP1, PARP9 NPY2R 2917/4885NPY4R 4054/4885NPY5R 1023/4885
US-20240082231-A1 NIRAPARIB FORMULATIONS PARP2, PARP1, PARP9 NPY2R 2917/4885NPY4R 4054/4885NPY5R 1023/4885

“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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