SCHEMBL29047135

SCHEMBL29047135

CC1(C)CCCC2=C1C(C=O)C(C=O)=CC2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.34
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNB4 P30926 1/20 0.34
▸ CHRNA3 P32297 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ POLB P06746 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
SCHEMBL2123286 0.62 POLB (0.33) POLB
SCHEMBL29626011 0.62 POLB (0.45) POLB
SCHEMBL229947 0.62 POLB (0.45) POLB
SCHEMBL30379423 0.62 POLB (0.45) POLB
SCHEMBL15199501 0.62 POLB (0.45) POLB
SCHEMBL22345198 0.58 — —
SCHEMBL20590509 0.57 POLB (0.31) POLB
SCHEMBL19974221 0.57 ALDH1A1 (0.33) POLB
SCHEMBL24531919 0.56 ALDH1A1 (0.37) POLB
SCHEMBL23986724 0.56 ALDH1A1 (0.37) POLB

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 4 patents. 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 claimed
CN-118048210-A Detergent composition 广州立白企业集团有限公司 2024-05-17 — — CN disclosed
CN-117794504-A Iris root extract, compositions and methods for dermatological use 捷通国际有限公司 2024-03-29 — — CN disclosed
CN-116528818-A Synergistic perfuming composition 弗门尼舍有限公司 2023-08-01 — — CN disclosed
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