SCHEMBL11524808

SCHEMBL11524808

C[C@@H](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]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CCS)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 18/20 0.59
▸ C5AR1 P21730 1/20 0.57

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
SCHEMBL11524792 1.00 IL23R (0.59) IL23RC5AR1
SCHEMBL11525047 0.95 IL23R (0.54) IL23RC5AR1
SCHEMBL11525060 0.95 IL23R (0.54) IL23RC5AR1
SCHEMBL11411927 0.94 C5AR1 (0.58) IL23RC5AR1
SCHEMBL11411902 0.94 C5AR1 (0.58) IL23RC5AR1
SCHEMBL11522373 0.92 IL23R (0.68) IL23R
SCHEMBL11324441 0.88 IL23R (0.54) IL23RC5AR1
SCHEMBL11324402 0.88 IL23R (0.54) IL23RC5AR1
SCHEMBL11648030 0.88 IL23R (0.56) IL23RC5AR1
SCHEMBL11647976 0.88 IL23R (0.56) IL23RC5AR1

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-4180500-A Polypeptides related to somatostatin AMERICAN HOME PRODUCTS CORPORATION (US) 1979-12-25 — — US claimed
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