SCHEMBL30380456

SCHEMBL30380456

C[C@@H](O)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 13/20 0.64
▸ KISS1R Q969F8 4/20 0.59
▸ GHSR Q92847 1/20 0.58

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
SCHEMBL29872066 1.00 IL23R (0.64) IL23RKISS1RGHSR
SCHEMBL30513340 1.00 IL23R (0.64) IL23RKISS1RGHSR
SCHEMBL29433930 1.00 IL23R (0.64) IL23RKISS1RGHSR
SCHEMBL31619566 0.97 IL23R (0.61) IL23R
SCHEMBL30276251 0.97 IL23R (0.64) IL23RKISS1RGHSR
SCHEMBL30379397 0.97 IL23R (0.64) IL23RKISS1RGHSR
SCHEMBL38662290 0.97 IL23R (0.64) IL23RKISS1RGHSR
SCHEMBL31619557 0.97 IL23R (0.64) IL23RKISS1RGHSR
SCHEMBL31091578 0.97 IL23R (0.66) IL23RGHSR
SCHEMBL29507073 0.97 GHSR (0.60) IL23RKISS1RGHSR

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-116041432-A Radioactive polypeptide 68Ga-DOTA-PG01 of targeted ALK fusion protein, and preparation method and application thereof 南京硼高生物科技有限公司 2023-05-02 — — CN claimed
CN-116041432-A Radioactive polypeptide 68Ga-DOTA-PG01 of targeted ALK fusion protein, and preparation method and application thereof 南京硼高生物科技有限公司 2023-05-02 — — CN disclosed
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