SCHEMBL5075258

SCHEMBL5075258

CCCCc1ccc(Oc2cc(Oc3ccc(CCCC)cc3)cc(C(=O)c3ccc(O)cc3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.52
LTA4H P09960 2/20 0.48
SRD5A2 P31213 2/20 0.47
ESR1 P03372 3/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
LMNA P02545 2/20 0.46
ACHE P22303 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
SHBG P04278 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
HSPD1 P10809 1/20 0.46
ADRB3 P13945 1/20 0.46
HTR2C P28335 1/20 0.46

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
SCHEMBL10076345 0.84 SRD5A2 (0.55) CNR2LTA4HSRD5A2ESR1LMNA
SCHEMBL7485086 0.84 ESR1 (0.63) CNR2ESR1ADRA2AADORA3TACR2
SCHEMBL5075005 0.84 GRIN2D (0.43) CNR2SRD5A2ESR1ADRA2AADORA3
SCHEMBL1837233 0.83 LTA4H (0.67) LTA4HESR1ADRA2AADORA3TACR2
SCHEMBL5712264 0.81 LTA4H (0.51) LTA4HESR1ADRA2AADORA3TACR2
SCHEMBL1835169 0.78 ESR1 (0.75) LTA4HESR1ADRA2AADORA3TACR2
SCHEMBL1404028 0.78 RARB (0.67) CNR2ALDH1A1HSD17B10RARBPLK1
SCHEMBL21656831 0.77 RARB (0.73) SRD5A2ALDH1A1TP53HSD17B10RARB
SCHEMBL7481808 0.77 MEN1 (0.54) LMNAACHEALDH1A1RARBMAPK1
SCHEMBL1840589 0.77 ESR1 (0.79) LTA4HESR1ADRA2AADORA3TACR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1359176-B1 Polycarbonates, polyestercarbonates and polyesters having specific branched endgroups BAYER MATERIALSCIENCE AG (DE) 2008-08-27 EP disclosed
US-6825312-B2 POLYCARBONATESTER COPOLYMER MOLDING MATERIALS BAYER AKTIENGESELLSCHAFT (DE) 2004-11-30 US disclosed
US-20040030090-A1 Polycarbonates, polyester carbonates and polyesters with special branched terminal groups BAYER AKTIENGESELLSCHAFT (DE) 2004-02-12 US disclosed
EP-1359176-A2 Polycarbonates, polyestercarbonates and polyesters having specific branched endgroups Bayer Aktiengesellschaft (DE) 2003-11-05 EP disclosed