SCHEMBL30788330

SCHEMBL30788330

CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.50
▸ GLP1R P43220 10/20 0.49
▸ SCTR P47872 1/20 0.49
▸ CRHR1 P34998 1/20 0.47
▸ CRHR2 Q13324 1/20 0.47
▸ IL23R Q5VWK5 1/20 0.47
▸ C5AR1 P21730 1/20 0.46
▸ VIPR2 P41587 1/20 0.46
▸ OPRD1 P41143 1/20 0.46
▸ GCGR P47871 1/20 0.45

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
SCHEMBL31189098 0.88 OPRD1 (0.48) CALCRGLP1RSCTRIL23RC5AR1
SCHEMBL29367449 0.88 GLP1R (0.58) CALCRGLP1RSCTRCRHR1CRHR2
SCHEMBL29364498 0.88 GLP1R (0.58) CALCRGLP1RSCTRCRHR1CRHR2
SCHEMBL29367002 0.88 GLP1R (0.58) CALCRGLP1RSCTRCRHR1CRHR2
SCHEMBL29367867 0.88 GLP1R (0.58) CALCRGLP1RSCTRCRHR1CRHR2
SCHEMBL30668692 0.87 CRHR1 (0.55) CALCRGLP1RSCTRCRHR1CRHR2
SCHEMBL29499670 0.86 CALCR (0.56) CALCRGLP1RSCTRCRHR1CRHR2
SCHEMBL30084580 0.86 OPRD1 (0.55) GLP1RSCTRIL23ROPRD1
SCHEMBL30209624 0.86 OPRM1 (0.54) CALCRGLP1RSCTRCRHR1CRHR2
SCHEMBL30974489 0.85 OPRD1 (0.49) CALCRGLP1RSCTRCRHR1CRHR2

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
EP-3139955-B1 FUSION PROTEINS FOR TREATING CANCER AND RELATED METHODS HARVARD COLLEGE (US) 2024-03-20 — — EP claimed
EP-3139955-B1 FUSION PROTEINS FOR TREATING CANCER AND RELATED METHODS HARVARD COLLEGE (US) 2024-03-20 — — EP disclosed
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