SCHEMBL8188706

SCHEMBL8188706

CCCOc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(-c3ccc(OCCC)cc3OCCC)n2)c(OCCC)c1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK13 O15264 1/20 0.41
▸ GCGR P47871 1/20 0.41
▸ MAPK12 P53778 1/20 0.41
▸ MAPK11 Q15759 1/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ PDE10A Q9Y233 1/20 0.38
▸ ACACB O00763 1/20 0.38
▸ ACACA Q13085 1/20 0.38

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
SCHEMBL8188702 0.88 KDM4E (0.41) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL30526017 0.79 GCGR (0.41) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL30526015 0.79 GCGR (0.41) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL21670594 0.79 GCGR (0.41) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL21670555 0.79 GCGR (0.41) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL21670562 0.76 SMN1; SMN2 (0.43) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL30525973 0.76 SMN1; SMN2 (0.43) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL21670551 0.76 SMN1; SMN2 (0.43) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL30525962 0.76 SMN1; SMN2 (0.43) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL21670510 0.74 ATP4A (0.41) MAPK13GCGRMAPK12MAPK11MAPK14

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
US-6015907-A PHOTOSTABLE IMAGING DYES FOR ACID-MEDIATED MEDIA, ALSO FOR PHOTOSENSITIZING ONIUM SALTS TO VISIBLE BLUE RADIATION POLAROID CORPORATION (US) 2000-01-18 — — US disclosed
Send feedback