SCHEMBL29047162

SCHEMBL29047162

CCCCCCCCC(C)(C)C=Cc1ccc(C=CC(C)(C)CCCCCCCC)cc1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.39
KDM4A O75164 2/20 0.38
KDM2A Q9Y2K7 2/20 0.38
APP P05067 4/20 0.37
EGFR P00533 1/20 0.37
KCNH2 Q12809 1/20 0.36
CNR2 P34972 1/20 0.36

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
SCHEMBL2787746 0.91 EGFR (0.48) EGFR
SCHEMBL6858892 0.91 EGFR (0.48) EGFR
SCHEMBL2785211 0.89 EGFR (0.45) EGFR
SCHEMBL18922064 0.76 TRPA1 (0.46) APP
SCHEMBL11093287 0.74 CYP2C19 (0.46) EGFR
SCHEMBL18922083 0.73 CYP1A2 (0.47)
SCHEMBL9576063 0.72 EGFR (0.43) EGFRKCNH2CNR2
SCHEMBL23406262 0.72 EGFR (0.50) EGFR
SCHEMBL9052165 0.70 TSHR (0.33)
SCHEMBL5142088 0.70 TSHR (0.44)

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
CN-116568786-A Synergistic perfuming composition 弗门尼舍有限公司 2023-08-08 CN disclosed