SCHEMBL14063107

SCHEMBL14063107

C(#Cc1ccc(-c2ccc(OCOCC3CO3)cc2)cc1)c1ccc(OCOCC2CO2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.46
▸ TSHR P16473 4/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ TP53 P04637 3/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ HIF1A Q16665 2/20 0.44
▸ PKM P14618 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ PPARG P37231 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MCHR1 Q99705 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ HRH3 Q9Y5N1 3/20 0.34
▸ HRH2 P25021 2/20 0.34

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
SCHEMBL14062972 0.95 TDP1 (0.50) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL14063104 0.95 TDP1 (0.50) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL14063127 0.93 TDP1 (0.49) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL14063008 0.92 TDP1 (0.53) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL14062949 0.92 TDP1 (0.53) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL14063019 0.90 TDP1 (0.52) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL13340862 0.89 MEN1 (0.50) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL14063110 0.88 TDP1 (0.59) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL14062660 0.88 TSHR (0.45) TDP1TSHRALDH1A1TP53MEN1
SCHEMBL12242468 0.87 TDP1 (0.39) TDP1TSHRALDH1A1TP53MEN1

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-7425354-B2 Photopolymerizable liquid crystal composition, its polymer or polymer composition, and optical compensation element CHISSO CORPORATION (JP) 2008-09-16 — — US disclosed
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