SCHEMBL6400197

SCHEMBL6400197

Cc1cc(C)cc(-c2c(O)cccc2C2(c3cccc(O)c3-c3cc(C)cc(C)c3)CCCCC2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.41
ESR2 Q92731 3/20 0.41
CNR2 P34972 4/20 0.37
CNR1 P21554 3/20 0.37
ACHE P22303 1/20 0.37
TSHR P16473 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ELANE P08246 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
BRCA1 P38398 1/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PGR P06401 1/20 0.35
HDAC4 P56524 2/20 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
SCHEMBL6400202 0.82 ACHE (0.40) ESR1ESR2CNR2CNR1ACHE
SCHEMBL29577228 0.81 PGR (0.39) ESR1ESR2ALDH1A1CYP3A4MAPT
SCHEMBL28077328 0.76 CNR2 (0.48) CNR2CNR1ACHETSHRMEN1
SCHEMBL29993063 0.75 ESR1 (0.44) ESR1ESR2ACHEPGRHDAC4
SCHEMBL11401705 0.75 ESR1 (0.44) ESR1ESR2ACHEPGRHDAC4
SCHEMBL8064831 0.73 ESR1 (0.47) ESR1ESR2ACHEMEN1KMT2A
SCHEMBL379394 0.72 ESR1 (0.46) ESR1ESR2ACHEMEN1KMT2A
SCHEMBL31490381 0.72 ESR1 (0.46) ESR1ESR2ACHEMEN1KMT2A
SCHEMBL2640042 0.72 ESR1 (0.46) ESR1ESR2ACHEMEN1KMT2A
SCHEMBL8840942 0.71 ALDH1A1 (0.44) ESR1ESR2ACHEKDM4EALDH1A1

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-6849706-B1 Copolyetherimides GENERAL ELECTRIC COMPANY (US) 2005-02-01 US claimed