SCHEMBL11038014

SCHEMBL11038014

CCOC(=O)CNC(=O)C1(C)CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.45
EPHX2 P34913 2/20 0.43
PPID Q08752 4/20 0.42
PPIB P23284 1/20 0.42
PPIA P62937 1/20 0.42
PPIG Q13427 1/20 0.42
CYP3A4 P08684 2/20 0.41
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
NLRP3 Q96P20 2/20 0.40
TSHR P16473 2/20 0.39
HSD17B10 Q99714 1/20 0.39
CTSS P25774 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
P2RX7 Q99572 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL22010661 0.83 GAA (0.41) GAAEPHX2PPIDPPIBPPIA
SCHEMBL11290272 0.82 GAA (0.44) GAAEPHX2PPIDPPIBPPIA
SCHEMBL580416 0.79 EPHX2 (0.43) GAAEPHX2PPIDPPIBPPIA
SCHEMBL1651948 0.77 MME (0.55) CYP3A4SMN1; SMN2P2RX7ALDH1A1
SCHEMBL10304246 0.76 DRD2 (0.41) GAASMN1; SMN2P2RX7ALDH1A1
SCHEMBL16775484 0.75 GAA (0.52) GAAEPHX2MGAMSIMGAM2
SCHEMBL11427402 0.74 EPHX2 (0.40) GAAEPHX2PPIDPPIBPPIA
SCHEMBL11427404 0.74 EPHX2 (0.40) GAAEPHX2PPIDPPIBPPIA
SCHEMBL26081876 0.74 ALDH1A1 (0.40) SMN1; SMN2P2RX7ALDH1A1
SCHEMBL25857186 0.72 GAA (0.43) GAAEPHX2PPIDPPIBPPIA

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
JP-59196849-A None JP disclosed
JP-S59196849-A NOVEL CARBOXYLIC ACID DERIVATIVE HISAMITSU PHARMACEUT CO INC 1984-11-08 JP disclosed