SCHEMBL29587664

SCHEMBL29587664

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 16/20 0.62
▸ NPY1R P25929 10/20 0.62
▸ NPY5R Q15761 8/20 0.62
▸ NPY2R P49146 6/20 0.62
▸ OPRK1 P41145 2/20 0.56
▸ KISS1R Q969F8 1/20 0.54

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
SCHEMBL29666890 0.98 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2ROPRK1
SCHEMBL29666931 0.98 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2ROPRK1
SCHEMBL29666876 0.98 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2ROPRK1
SCHEMBL29586394 0.95 NPY4R (0.66) NPY4RNPY1RNPY5RNPY2ROPRK1
SCHEMBL29666869 0.94 NPY4R (0.67) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29666920 0.94 NPY4R (0.67) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29666907 0.94 NPY4R (0.67) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29940984 0.92 NPY4R (0.71) NPY4RNPY1RNPY5RNPY2ROPRK1
SCHEMBL29790419 0.92 NPY4R (0.66) NPY4RNPY1RNPY5RNPY2ROPRK1
SCHEMBL29941335 0.92 NPY4R (0.71) NPY4RNPY1RNPY5RNPY2ROPRK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114404417-B Dendritic polypeptide-camptothecin drug conjugate and preparation method and application thereof 广东晨康生物科技有限公司 2023-06-13 — — CN disclosed
CN-114404417-A Dendritic polypeptide-camptothecin drug conjugate as well as preparation method and application thereof 佛山市晨康生物科技有限公司 2022-04-29 — — CN disclosed
Send feedback