SCHEMBL20727180

SCHEMBL20727180

CC1C=C(C(c2ccc(OCC3CO3)cc2)c2ccc(OCC3CO3)cc2)C=CC1OCC1CO1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ TP53 P04637 3/20 0.42
▸ TSHR P16473 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ HIF1A Q16665 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.40
▸ PKM P14618 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CYP3A4 P08684 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GLA P06280 1/20 0.33
▸ GRM2 Q14416 1/20 0.31

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
SCHEMBL24245304 0.76 TDP1 (0.42) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL14191969 0.76 ALDH1A1 (0.60) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL14388708 0.75 TDP1 (0.63) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL15246778 0.75 TDP1 (0.63) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL17356545 0.75 TDP1 (0.63) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL50130 0.75 TDP1 (0.63) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL17359243 0.75 TDP1 (0.63) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL21202705 0.73 ALDH1A1 (0.60) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL16640986 0.71 ALDH1A1 (0.55) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL17897424 0.71 ALDH1A1 (0.55) ALDH1A1TP53TSHRMAPTHPGD

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
EP-2850146-B1 CHAIN EXTENDED EPOXY TO IMPROVE ADHESION OF CONDUCTIVE DIE ATTACH FILM Henkel IP & Holding GmbH (DE) 2019-02-13 — — EP disclosed
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