SCHEMBL8978166

SCHEMBL8978166

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 1/20 0.46
▸ HCRTR2 O43614 1/20 0.46
▸ CALCR P30988 4/20 0.45
▸ F2 P00734 4/20 0.44
▸ GLP1R P43220 6/20 0.43
▸ IL23R Q5VWK5 1/20 0.41
▸ OXTR P30559 1/20 0.41
▸ CRHR1 P34998 1/20 0.40
▸ CRHR2 Q13324 1/20 0.40

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
SCHEMBL30136928 0.86 GLP1R (0.47) HCRTR1HCRTR2CALCRF2GLP1R
SCHEMBL30512637 0.86 F2 (0.48) HCRTR1HCRTR2CALCRF2GLP1R
SCHEMBL30906333 0.85 CALCR (0.56) HCRTR1HCRTR2CALCRGLP1RCRHR1
SCHEMBL30168779 0.85 CALCR (0.51) HCRTR1HCRTR2CALCRF2GLP1R
SCHEMBL30168710 0.85 CALCR (0.51) HCRTR1HCRTR2CALCRF2GLP1R
SCHEMBL30136891 0.84 CALCR (0.50) HCRTR1HCRTR2CALCRGLP1RCRHR1
SCHEMBL29836368 0.84 CALCR (0.50) HCRTR1HCRTR2CALCRF2GLP1R
SCHEMBL29836375 0.84 CALCR (0.50) HCRTR1HCRTR2CALCRF2GLP1R
SCHEMBL30512576 0.83 CALCR (0.47) HCRTR1HCRTR2CALCRF2GLP1R
SCHEMBL30973977 0.82 GLP1R (0.47) HCRTR1HCRTR2CALCRF2GLP1R

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-5516657-A Baculovirus vectors for expression of secretory and membrane-bound proteins CAMBRIDGE BIOTECH CORPORATION (US) 1996-05-14 — — US disclosed
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