SCHEMBL6443870

SCHEMBL6443870

C=Cc1cc(OC)c(O)c(OC)c1.C=Cc1cc(OC)c(O)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.62
▸ KMT2A Q03164 4/20 0.61
▸ MAPT P10636 3/20 0.61
▸ GAA P10253 1/20 0.61
▸ ABL1 P00519 1/20 0.57
▸ BCR P11274 1/20 0.57
▸ CYP3A4 P08684 3/20 0.55
▸ CYP2B6 P20813 2/20 0.55
▸ CYP1A2 P05177 2/20 0.55
▸ CYP2C9 P11712 2/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ PKM P14618 2/20 0.53
▸ PTGS1 P23219 1/20 0.53
▸ PTGS2 P35354 1/20 0.53
▸ TUBB1 Q9H4B7 1/20 0.52
▸ LMNA P02545 3/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ BLM P54132 2/20 0.50

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
SCHEMBL727024 1.00 TRPA1 (0.62) TRPA1KMT2AMAPTGAAABL1
SCHEMBL3703392 0.91 TRPA1 (0.63) TRPA1KMT2AMAPTGAAABL1
SCHEMBL18116476 0.88 EGFR (0.58) TRPA1KMT2AMAPTGAAABL1
SCHEMBL22991659 0.86 APP (0.59) TRPA1KMT2AMAPTGAAABL1
SCHEMBL29696089 0.86 APP (0.59) TRPA1KMT2AMAPTGAAABL1
SCHEMBL28561856 0.83 ALOX5 (0.55) TRPA1KMT2AMAPTGAAABL1
SCHEMBL28569874 0.83 TRPA1 (0.50) TRPA1KMT2AMAPTGAAABL1
SCHEMBL22917545 0.83 ERN1 (0.62) TRPA1MAPTLMNA
SCHEMBL24400965 0.83 TRPA1 (0.73) TRPA1KMT2AMAPTGAACYP3A4
SCHEMBL31454779 0.82 PKM (0.50) TRPA1KMT2AMAPTGAAABL1

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-20050042354-A1 Antiradicals and fat compositions, foods, drinks, drugs or feeds containing the antiradicals THE JAPANESE RESEARCH AND DEVELOPMENT ASSOCIATION FOR NEW FUNCTIONAL FOODS (JP) 2005-02-24 — — US disclosed
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