SCHEMBL9718190

SCHEMBL9718190

CC(C)c1[c]cc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 2/20 0.34
CDC25A P30304 1/20 0.33
CDC25B P30305 1/20 0.33
PDE4B Q07343 3/20 0.32
PDE4A P27815 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 2/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
METAP2 P50579 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA2B P29275 1/20 0.30
ADORA1 P30542 1/20 0.30
MET P08581 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL2158946 0.86 USP7 (0.33) GCGRCDC25ACDC25BPDE4BPDE4A
SCHEMBL16150176 0.78 GCGR (0.34) GCGRCDC25ACDC25BPDE4BPDE4A
SCHEMBL12816030 0.75 CYP2A6 (0.36) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL770088 0.72 LMNA (0.36) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL22129263 0.70 PTGS1 (0.35) GCGRPDE4BPDE4APDE4CPDE4D
SCHEMBL8480921 0.69 PDCD1 (0.36) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL2160199 0.69 CDC25A (0.38) CDC25ACDC25BMAPTHTTMETAP2
SCHEMBL28926448 0.68 BACE1 (0.39) CDC25ACDC25BLMNAMAPTMETAP2
SCHEMBL11326822 0.67 GCGR (0.37) GCGRCDC25ACDC25BPDE4BPDE4A
SCHEMBL9933563 0.67 CDC25A (0.33) CDC25ACDC25BMETAP2ADORA3ADORA2A

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-0473915-A1 Improved barrier PVC resins, compounds and articles derived therefrom THE B.F. GOODRICH COMPANY (US) 1992-03-11 EP disclosed