SCHEMBL11420715

SCHEMBL11420715

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

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 11/20 0.59
▸ GHSR Q92847 3/20 0.58
▸ UTS2R Q9UKP6 1/20 0.55
▸ PRMT1 Q99873 1/20 0.53
▸ KISS1R Q969F8 1/20 0.53

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
SCHEMBL11420763 1.00 IL23R (0.59) IL23RGHSRUTS2RPRMT1KISS1R
SCHEMBL29938218 0.97 GHSR (0.58) IL23RGHSRUTS2RPRMT1KISS1R
SCHEMBL31514537 0.97 IL23R (0.61) IL23RGHSRUTS2R
SCHEMBL29364031 0.97 IL23R (0.61) IL23RGHSRUTS2R
SCHEMBL11206834 0.97 IL23R (0.61) IL23RGHSRUTS2R
SCHEMBL11206825 0.97 IL23R (0.61) IL23RGHSRUTS2R
SCHEMBL11410421 0.97 IL23R (0.64) IL23RGHSRUTS2RKISS1R
SCHEMBL11410468 0.97 IL23R (0.64) IL23RGHSRUTS2RKISS1R
SCHEMBL29564504 0.96 GHSR (0.56) IL23RGHSRUTS2RPRMT1KISS1R
SCHEMBL29564832 0.96 GHSR (0.56) IL23RGHSRUTS2RPRMT1KISS1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4182707-A Somatostatin analogues AMERICAN HOME PRODUCTS CORPORATION (US) 1980-01-08 — — US claimed
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