SCHEMBL29783638

SCHEMBL29783638

C[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 9/20 0.49
▸ NPY5R Q15761 8/20 0.49
▸ NPY1R P25929 7/20 0.49
▸ NPY2R P49146 5/20 0.46
▸ IL23R Q5VWK5 1/20 0.46
▸ OPRM1 P35372 1/20 0.45
▸ OPRD1 P41143 1/20 0.45
▸ OPRK1 P41145 1/20 0.45
▸ TFPI P10646 1/20 0.45

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
SCHEMBL30265523 0.91 NPY4R (0.54) NPY4RNPY5RNPY1RNPY2R
SCHEMBL30264923 0.91 NPY4R (0.54) NPY4RNPY5RNPY1RNPY2R
SCHEMBL31433247 0.91 NPY4R (0.59) NPY4RNPY5RNPY1RNPY2RTFPI
SCHEMBL31433365 0.90 TFPI (0.54) NPY4RNPY5RNPY1RNPY2RIL23R
SCHEMBL30264953 0.88 NPY4R (0.51) NPY4RNPY5RNPY1RNPY2R
SCHEMBL30265009 0.88 NPY4R (0.58) NPY4RNPY5RNPY1RNPY2R
SCHEMBL30866924 0.87 NPY4R (0.56) NPY4RNPY5RNPY1RNPY2R
SCHEMBL29743134 0.87 IL23R (0.51) NPY4RNPY5RNPY1RNPY2RIL23R
SCHEMBL30264901 0.87 FNTA (0.52) NPY4RNPY5RNPY1RNPY2ROPRM1
SCHEMBL31433292 0.86 NPY4R (0.55) NPY4RNPY5RNPY1RNPY2RIL23R

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-12103951-B2 Use of CGRP receptor antagonists in neuroprotection and neurological disorders SOARES CHRISTOPHER JOSEPH (US) 2024-10-01 — — US disclosed
EP-4316595-A2 USE OF CGRP RECEPTOR ANTAGONISTS IN TREATING GLAUCOMA Soares, Christopher, J. (US) 2024-02-07 — — EP disclosed
EP-3506925-B1 USE OF CGRP RECEPTOR ANTAGONISTS IN TREATING GLAUCOMA SOARES CHRISTOPHER J (US) 2023-09-06 — — EP disclosed
US-20230212248-A1 USE OF CGRP RECEPTOR ANTAGONISTS IN NEUROPROTECTION AND NEUROLOGICAL DISORDERS SOARES CHRISTOPHER JOSEPH (US) 2023-07-06 — — US disclosed
US-11390654-B2 Use of CGRP receptor antagonists in neuroprotection and neurological disorders SOARES CHRISTOPHER JOSEPH (US) 2022-07-19 — — US disclosed
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