SCHEMBL631983

SCHEMBL631983

CCC1CC(NC(=O)C(=O)N2CCN(c3ccccc3C(C)(C)C)CC2)CCN1CC(=O)OOOC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 15/20 0.46
GAA P10253 1/20 0.37
SSTR4 P31391 1/20 0.35
HTR1A P08908 1/20 0.35
RAB9A P51151 1/20 0.34
MC4R P32245 1/20 0.33

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
SCHEMBL766182 0.81 RBP4 (0.59) RBP4GAASSTR4HTR1A
SCHEMBL766290 0.75 RBP4 (0.60) RBP4GAAHTR1ARAB9A
SCHEMBL631984 0.74 RBP4 (0.54) RBP4GAA
SCHEMBL766438 0.74 RBP4 (0.73) RBP4GAARAB9A
SCHEMBL766146 0.73 RBP4 (0.64) RBP4GAAHTR1A
SCHEMBL766199 0.73 RBP4 (0.59) RBP4GAARAB9A
SCHEMBL766258 0.73 RBP4 (0.57) RBP4RAB9A
SCHEMBL766135 0.71 RBP4 (0.60) RBP4GAAHTR1ARAB9A
SCHEMBL18255760 0.71 RBP4 (0.60) RBP4GAA
SCHEMBL27857003 0.71 RBP4 (0.55) RBP4GAAHTR1A

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
EP-2419413-A1 DERIVATIVES OF N-ACYL-N'-PHENYLPIPERAZINE USEFUL (INTER ALIA) FOR THE PROPHYLAXIS OR TREATMENT OF DIABETES Takeda Pharmaceutical Company Limited (JP) 2012-02-22 EP disclosed