SCHEMBL31666085

SCHEMBL31666085

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 13/20 0.64
CCKBR P32239 3/20 0.64
RXFP1 Q9HBX9 1/20 0.63
IL23R Q5VWK5 1/20 0.63
PTH1R Q03431 1/20 0.62
ECE1 P42892 1/20 0.62
MUS81 Q96NY9 1/20 0.62
GCGR P47871 1/20 0.61
GIPR P48546 1/20 0.61
NPBWR1 P48145 2/20 0.61

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
SCHEMBL31666091 0.96 GLP1R (0.61) GLP1RCCKBRRXFP1IL23RPTH1R
SCHEMBL31666092 0.96 GLP1R (0.61) GLP1RCCKBRRXFP1IL23RPTH1R
SCHEMBL31666086 0.95 IL23R (0.66) GLP1RCCKBRIL23RGCGRGIPR
SCHEMBL31666087 0.95 IL23R (0.65) GLP1RCCKBRIL23RGCGRGIPR
SCHEMBL31666090 0.94 GLP1R (0.66) GLP1RCCKBRRXFP1IL23RPTH1R
SCHEMBL31666088 0.93 GLP1R (0.66) GLP1RCCKBRRXFP1IL23RPTH1R
SCHEMBL31666089 0.93 GLP1R (0.66) GLP1RCCKBRRXFP1IL23RPTH1R
SCHEMBL30658341 0.91 GLP1R (0.69) GLP1RCCKBRRXFP1IL23RPTH1R
SCHEMBL30625832 0.91 GLP1R (0.68) GLP1RCCKBRECE1MUS81NPBWR1
SCHEMBL31694503 0.90 PTH1R (0.72) GLP1RCCKBRRXFP1IL23RPTH1R

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
US-12371691-B2 Nano complex for targeted repairing of neurovascular lesion, and preparation and use thereof SHANGHAI JIAOTONG UNIVERSITY SCHOOL OF MEDICINE (CN) 2025-07-29 US claimed
US-12371691-B2 Nano complex for targeted repairing of neurovascular lesion, and preparation and use thereof SHANGHAI JIAOTONG UNIVERSITY SCHOOL OF MEDICINE (CN) 2025-07-29 US disclosed