SCHEMBL9957956

SCHEMBL9957956

CCC(=O)C=C[C@@H]1C(C)=CCCC1(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 1.00
CYP3A4 P08684 1/20 1.00
ALOX15 P16050 1/20 1.00
TDP1 Q9NUW8 1/20 1.00
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL2449759 1.00 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL17627765 1.00 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL31141470 1.00 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL115151 1.00 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL132162 1.00 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL17627764 1.00 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL20165768 1.00 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL31141469 1.00 ALDH1A1 (1.00) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL28235614 0.95 ALDH1A1 (0.90) ALDH1A1CYP3A4ALOX15TDP1KDM4E
SCHEMBL12593725 0.91 ALDH1A1 (0.83) ALDH1A1CYP3A4ALOX15TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017223033-A1 AQUEOUS FRESHENING COMPOSITIONS AND FRESHENING PRODUCTS COMPRISING THE AQUEOUS FRESHENING COMPOSITIONS CONTAINED IN PRESSURIZED PLASTIC CONTAINERS THE PROCTER & GAMBLE COMPANY (US) 2017-12-28 WO disclosed
EP-2468308-A1 Absorbent article having releasable odor control THE PROCTER & GAMBLE COMPANY (US) 2012-06-27 EP disclosed