SCHEMBL1567092

SCHEMBL1567092

OC(OCc1cccc2ccccc12)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.43
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
PSMB5 P28074 1/20 0.36
FFAR1 O14842 1/20 0.34
AKR1B1 P15121 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 2/20 0.34
PARP10 Q53GL7 1/20 0.34
EPHX1 P07099 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
NPC1 O15118 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
SCHEMBL163296 0.80 SLC1A3 (0.51) SLC1A3SLC1A2SLC1A1PSMB5FFAR1
SCHEMBL9610281 0.69 PNMT (0.57) PNMTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6675750 0.69 PNMT (0.50) PNMTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL29555007 0.69 PNMT (0.50) PNMTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL2231457 0.68 NPC1 (0.47) PNMTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL263230 0.67 PNMT (0.68) PNMTMEN1KMT2AALDH1A1SMN1; SMN2
Fluorene SCHEMBL28444035 0.67 PNMT (0.49) PNMTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL23259396 0.67 PNMT (0.54) PNMTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9610282 0.67 PNMT (0.54) PNMTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL28836883 0.67 PNMT (0.62) PNMTMEN1KMT2AALDH1A1SMN1; SMN2

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-2308960-A1 CELL ADHESION PROMOTING AGENT AND METHOD OF PROMOTING CELL ADHESION Kyoto University (JP) 2011-04-13 EP disclosed