SCHEMBL5485349

SCHEMBL5485349

C[C](ON1C(C)(C)CCCC1(C)C)c1ccc(O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.39
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ESR2 Q92731 5/20 0.35
HSD17B10 Q99714 1/20 0.33
TSHR P16473 2/20 0.32
MEN1 O00255 1/20 0.32
NQO2 P16083 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
HSD17B1 P14061 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32

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
SCHEMBL7147761 0.85 LMNA (0.38) ESR1KMT2AALDH1A1HPGDMAPT
SCHEMBL5471885 0.80 ESR1 (0.49) ESR1KMT2AALDH1A1HPGDMAPT
SCHEMBL6544700 0.74 GAA (0.54) ESR1KMT2AALDH1A1HPGDMAPT
SCHEMBL10605851 0.70 MEN1 (0.38) ESR1KMT2AALDH1A1HPGDMAPT
SCHEMBL9039578 0.69 ESR1 (0.38) ESR1ALDH1A1MAPTCYP1A2CYP2C9
SCHEMBL27403915 0.69 TSHR (0.49) ESR1KMT2AALDH1A1MAPTHSD17B10
SCHEMBL27575659 0.67 ESR2 (0.39) ESR1KMT2AALDH1A1HPGDMAPT
SCHEMBL10717862 0.67 GAA (0.43) ESR1KMT2AALDH1A1HPGDMAPT
SCHEMBL4625144 0.67 KMT2A (0.61) ESR1KMT2AALDH1A1HPGDMAPT
SCHEMBL986872 0.66 TSHR (0.41) ESR1KMT2AALDH1A1CYP2C19HSD17B10

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-20070106011-A1 Method for producing copolymeric polyacrylate pressure-sensitive adhesive substances, and nitroxide-modified polyacrylates and comb block polymers obtained thereby HUSEMANN MARC 2007-05-10 US disclosed