SCHEMBL2123286

SCHEMBL2123286

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

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL29626011 0.68 POLB (0.45) POLBALDH1A1TDP1
SCHEMBL229947 0.68 POLB (0.45) POLBALDH1A1TDP1
SCHEMBL23986724 0.66 ALDH1A1 (0.37) POLBALDH1A1TDP1
SCHEMBL15199501 0.65 POLB (0.45) POLBALDH1A1TDP1
SCHEMBL30379423 0.65 POLB (0.45) POLBALDH1A1TDP1
SCHEMBL8144900 0.64 ALDH1A1 (0.42) POLBALDH1A1TDP1
SCHEMBL19974221 0.62 ALDH1A1 (0.33) POLBALDH1A1TDP1
SCHEMBL29047135 0.62 TRPA1 (0.34) POLB
SCHEMBL28861559 0.61 ALDH1A1 (0.36) POLBALDH1A1TDP1
SCHEMBL30741243 0.59 ALDH1A1 (0.38) POLBALDH1A1TDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2809760-B1 PROCESS FOR REDUCING MALODOURS HENKEL AG & CO KGAA (DE) 2019-03-20 — — EP claimed
EP-2442783-A2 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME Robertet S.A. (FR) 2012-04-25 — — EP claimed
EP-2442783-A2 NOVEL DEODORISING COMPOSITIONS AND DEODORISING PRODUCTS CONTAINING SAME Robertet S.A. (FR) 2012-04-25 — — EP disclosed
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