SCHEMBL23254234

SCHEMBL23254234

C=C(/C=C\CC)N(C(=C)/C=C\CC)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ GLA P06280 1/20 0.36
▸ EGFR P00533 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ MEN1 O00255 3/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ ATM Q13315 1/20 0.31
▸ HPGD P15428 1/20 0.30

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
SCHEMBL22002870 0.85 NPSR1 (0.38) TSHRALDH1A1GLAEGFRTP53
SCHEMBL21913825 0.84 FAAH (0.39) TSHRALDH1A1GLAEGFRNPC1
SCHEMBL18814886 0.82 ALDH1A1 (0.50) TSHRALDH1A1GLATP53L3MBTL1
SCHEMBL23652017 0.79 MEN1 (0.34) TSHRALDH1A1GLAEGFRL3MBTL1
SCHEMBL18080843 0.77 BTK (0.31) —
SCHEMBL22751015 0.76 TP53 (0.30) TP53
SCHEMBL21301180 0.75 ALDH1A1 (0.46) TSHRALDH1A1GLATP53L3MBTL1
SCHEMBL16906012 0.73 MEN1 (0.31) MEN1KMT2A
SCHEMBL19870989 0.71 AKT1 (0.38) TSHRALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL2499404 0.71 ATM (0.42) ALDH1A1EGFRMEN1KMT2AATM

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-3428989-B1 LIGHT-EMITTING ELEMENT SUMITOMO CHEMICAL CO (JP) 2021-04-21 — — EP disclosed
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