SCHEMBL5510703

SCHEMBL5510703

CC1=C(CC=CC=O)C(C)(C)CCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.40
CYP3A4 P08684 5/20 0.40
ALOX15 P16050 4/20 0.40
APP P05067 3/20 0.40
SNCA P37840 3/20 0.40
TSHR P16473 2/20 0.40
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NR2E1 Q9Y466 1/20 0.40
RARB P10826 6/20 0.38
RARG P13631 6/20 0.38
RXRA P19793 6/20 0.38
RARA P10276 5/20 0.38
CYP1A2 P05177 2/20 0.37
HAO1 Q9UJM8 1/20 0.35
MAPT P10636 7/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALOX5 P09917 1/20 0.34
PTGS1 P23219 4/20 0.34

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
SCHEMBL3234778 1.00 ALDH1A1 (0.40) ALDH1A1CYP3A4ALOX15APPSNCA
SCHEMBL15156575 1.00 ALDH1A1 (0.40) ALDH1A1CYP3A4ALOX15APPSNCA
SCHEMBL881427 0.82 CYP1A2 (0.41) ALDH1A1CYP3A4ALOX15APPSNCA
SCHEMBL9483270 0.81 ALDH1A1 (0.43) ALDH1A1ALOX15RARBRARGRXRA
SCHEMBL5508599 0.81 ALDH1A1 (0.43) ALDH1A1ALOX15RARBRARGRXRA
SCHEMBL9182001 0.79 ALDH1A1 (0.49) ALDH1A1CYP3A4ALOX15APPSNCA
SCHEMBL9209859 0.79 ALDH1A1 (0.49) ALDH1A1CYP3A4ALOX15APPSNCA
SCHEMBL9187020 0.79 ALDH1A1 (0.49) ALDH1A1CYP3A4ALOX15APPSNCA
SCHEMBL2706976 0.78 CYP1A2 (0.56) ALDH1A1CYP3A4ALOX15APPSNCA
SCHEMBL5696341 0.78 CYP1A2 (0.45) ALDH1A1CYP3A4ALOX15APPSNCA

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649183-A1 SILICONE COMPOUNDS The Procter and Gamble Company (US) 2020-05-13 EP claimed
WO-2019010263-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2019-01-10 WO claimed
EP-1280882-A1 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-02-05 EP claimed
WO-2002090479-A1 PERFUMED PARTICLES AND ARTICLES CONTAINING THE SAME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
WO-2002090481-A1 COMPOSITIONS AND ARTICLES FOR EFFECTIVE DEPOSITION OF PERFUME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
WO-2001085892-A1 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-11-15 WO claimed
EP-4472763-A1 METHOD FOR PRODUCING MICROCAPSULES Symrise AG (DE) 2024-12-11 EP disclosed
EP-4387583-A1 ANTIMICROBIAL COMPOSITIONS Firmenich SA (CH) 2024-06-26 EP disclosed
WO-2023148253-A1 METHOD FOR PRODUCING MICROCAPSULES SYMRISE AG (DE) 2023-08-10 WO disclosed
WO-2023020929-A1 ANTIMICROBIAL COMPOSITIONS FIRMENICH SA (CH) 2023-02-23 WO disclosed
EP-3280525-A1 PROCESS FOR PREPARING POLYUREA MICROCAPSULES Firmenich SA (CH) 2018-02-14 EP disclosed
EP-3206660-A1 MALODOR REDUCING COMPOSITIONS Givaudan S.A. (CH) 2017-08-23 EP disclosed
WO-2016162381-A1 PROCESS FOR PREPARING POLYUREA MICROCAPSULES FIRMENICH SA (CH) 2016-10-13 WO disclosed
WO-2013116261-A2 COMPOSITIONS AND METHODS FOR SURFACE TREATMENT WITH LIPASES THE PROCTER & GAMBLE COMPANY (US) 2013-08-08 WO disclosed
WO-2012101241-A1 COMPOSITIONS GIVAUDAN SA (CH) 2012-08-02 WO disclosed
EP-1828365-A1 PERFUME DELIVERY SYSTEM Degussa GmbH (DE) 2007-09-05 EP disclosed
WO-2006069061-A1 PERFUME DELIVERY SYSTEM DEGUSSA GMBH (DE) 2006-06-29 WO disclosed
EP-1383858-A1 DRYER-ADDED FABRIC SOFTENING ARTICLES AND METHODS The Procter & Gamble Company (US) 2004-01-28 EP disclosed
WO-2002090480-A1 DRYER-ADDED FABRIC SOFTENING ARTICLES AND METHODS THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO disclosed
WO-2002090481-A1 COMPOSITIONS AND ARTICLES FOR EFFECTIVE DEPOSITION OF PERFUME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO disclosed