SCHEMBL5888928

SCHEMBL5888928

C=CCc1c[c]c(O)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.42
GABRB2 P47870 3/20 0.42
MEN1 O00255 7/20 0.37
KMT2A Q03164 7/20 0.37
MAPT P10636 4/20 0.36
LMNA P02545 3/20 0.36
POLB P06746 3/20 0.36
MAPK1 P28482 2/20 0.36
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 3/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
MAP4K4 O95819 1/20 0.33
RET P07949 1/20 0.33
IGF1R P08069 1/20 0.33
MET P08581 1/20 0.33
PIM1 P11309 1/20 0.33
LTK P29376 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
SCHEMBL5888903 0.79 GABRA1 (0.47) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL5831736 0.74 GABRA1 (0.45) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL5843777 0.72 IDO1 (0.52) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL5888947 0.72 GABRA1 (0.37) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL9229519 0.70 MEN1 (0.51) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL31619949 0.69 GABRA1 (0.56) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL5831594 0.69 GABRA1 (0.56) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL1638775 0.68 GABRA1 (0.50) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL21409555 0.68 GABRA1 (0.55) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL1535644 0.68 IDO1 (0.50) MAPTLMNAPOLBNPC1HTT

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-7041388-B1 Substituted poly(arylene vinylenes), process for their preparation and their use in electroluminescent devices SEMICONDUCTORS GMBH (DE) 2006-05-09 US claimed