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Sugi Predict / Compounds / SCHEMBL11661276

SCHEMBL11661276

SCHEMBL11661276

CC(NC(=O)CNC(=O)CN)C(=O)NC(C)C(=O)NCC(=O)NC(CS)C(=O)NC(CCCCN)C(=O)NC(CC(N)=O)C(=O)NC(Cc1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(CCCCN)C(=O)NC(C(=O)NC(Cc1ccccc1)C(=O)NC(C(=O)NC(CO)C(=O)NC(CS)C(=O)O)C(C)O)C(C)O

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 17/20 0.58
▸ GLP1R P43220 2/20 0.56

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
SCHEMBL11661311 1.00 IL23R (0.58) IL23RGLP1R
SCHEMBL11722764 0.98 IL23R (0.60) IL23RGLP1R
SCHEMBL11658658 0.98 IL23R (0.60) IL23RGLP1R
SCHEMBL11658721 0.98 IL23R (0.60) IL23RGLP1R
SCHEMBL11784037 0.96 IL23R (0.64) IL23RGLP1R
SCHEMBL11783894 0.96 IL23R (0.64) IL23RGLP1R
SCHEMBL11727767 0.95 IL23R (0.61) IL23RGLP1R
SCHEMBL11727880 0.95 IL23R (0.61) IL23RGLP1R
SCHEMBL11522035 0.94 IL23R (0.60) IL23R
SCHEMBL11773766 0.94 IL23R (0.60) IL23R

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-4081530-A Extended chain derivatives of somatostatin AYERST, MCKENNA & HARRISON LIMITED (CA) 1978-03-28 — — US disclosed
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