SCHEMBL16615854

SCHEMBL16615854

CC(O)[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](N)CO)CCC(=O)NCCCC[C@@H](C(=O)N[C@@H](CO)CN[C@@H](Cc2ccccc2)C(=O)O)NC(=O)[C@H](CO)NC1=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SSTR2 P30874 4/20 0.50
SSTR4 P31391 4/20 0.50
SSTR5 P35346 4/20 0.50
SRC P12931 1/20 0.47
MC1R Q01726 1/20 0.47
SSTR1 P30872 4/20 0.46
SSTR3 P32745 1/20 0.46
OPRM1 P35372 2/20 0.43
OPRD1 P41143 2/20 0.43
OPRK1 P41145 2/20 0.43
MMP1 P03956 2/20 0.42
MMP2 P08253 2/20 0.42
MMP3 P08254 2/20 0.42
MMP9 P14780 2/20 0.42
MMP8 P22894 2/20 0.42

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
SCHEMBL16615864 0.96 SSTR5 (0.50) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL16615764 0.86 MC1R (0.46) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL16615857 0.85 SSTR1 (0.43) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL16615751 0.85 SSTR5 (0.47) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL16692279 0.83 SSTR2 (0.46) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL16615904 0.83 SRC (0.48) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL16691453 0.82 SRC (0.48) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL16615884 0.82 SSTR1 (0.43) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL15295869 0.82 SRC (0.46) SSTR2SSTR4SSTR5SRCMC1R
SCHEMBL16691478 0.82 SRC (0.51) SSTR2SSTR4SSTR5SRCMC1R

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
WO-2015044900-A1 THERAPEUTIC IMMUNOMODULATING COMPOUNDS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-04-02 WO disclosed