SCHEMBL14063154

SCHEMBL14063154

c1cc(-c2ccc3cc(OCOCC4CO4)ccc3c2)ccc1OCOCC1CO1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ TP53 P04637 3/20 0.46
▸ HIF1A Q16665 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.44
▸ MAPT P10636 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ PKM P14618 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ FGFR1 P11362 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ CYP11B1 P15538 2/20 0.35
▸ CYP11B2 P19099 2/20 0.35

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
SCHEMBL14063149 0.89 ALDH1A1 (0.59) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL14062949 0.89 TDP1 (0.53) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL14063008 0.89 TDP1 (0.53) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL14063019 0.87 TDP1 (0.52) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL13255877 0.85 ALDH1A1 (0.62) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL14063150 0.85 ALDH1A1 (0.39) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL14062717 0.82 TDP1 (0.41) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL14062669 0.81 ALDH1A1 (0.47) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL14063107 0.81 TDP1 (0.46) TSHRALDH1A1TP53HIF1ASMN1; SMN2
SCHEMBL14062589 0.81 TDP1 (0.46) TSHRALDH1A1TP53HIF1ASMN1; SMN2

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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