SCHEMBL9723670

SCHEMBL9723670

CC(C)C(O)(c1ccccc1)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C19 P33261 3/20 0.45
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 1/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
HIF1A Q16665 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
ALOX15 P16050 1/20 0.41
TTR P02766 1/20 0.39
ESR1 P03372 2/20 0.39
ESR2 Q92731 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK1 P28482 2/20 0.39
KCNN4 O15554 2/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL6470482 0.79 CYP2C19 (0.55) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL29608887 0.79 CYP2D6 (0.48) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL7995729 0.78 KCNA5 (0.53) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL3959121 0.77 CYP2D6 (0.47) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL12884227 0.77 CYP2D6 (0.47) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL765495 0.77 ALDH1A1 (0.40) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL18096775 0.77 CYP2C19 (0.40) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL301345 0.76 ALDH1A1 (0.57) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL6021075 0.76 ALDH1A1 (0.57) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10
SCHEMBL9363854 0.75 CYP2D6 (0.55) CYP2D6CYP1A2CYP2C19ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4604726-A1 ENHANCED YEASTICIDAL EFFICACY OF LACTIC ACID BASED ANTIMICROBIAL HANDWASH Ecolab USA Inc. (US) 2025-08-27 EP claimed
WO-2024086642-A1 ENHANCED YEASTICIDAL EFFICACY OF LACTIC ACID BASED ANTIMICROBIAL HANDWASH ECOLAB USA INC. (US) 2024-04-25 WO claimed
EP-4604726-A1 ENHANCED YEASTICIDAL EFFICACY OF LACTIC ACID BASED ANTIMICROBIAL HANDWASH Ecolab USA Inc. (US) 2025-08-27 EP disclosed
WO-2024086642-A1 ENHANCED YEASTICIDAL EFFICACY OF LACTIC ACID BASED ANTIMICROBIAL HANDWASH ECOLAB USA INC. (US) 2024-04-25 WO disclosed
US-5166400-A Intermediates for isopropyl 3S-amino-2R-hydroxy-alkanoates PFIZER INC. (US) 1992-11-24 US disclosed
US-5036155-A Process for isopropyl 3S-amino-2R-hydroxy-alkanoates PFIZER INC. (US) 1991-07-30 US disclosed
US-4965372-A Process and intermediates for isopropyl 3S-amino-2R-hydroxy-alkanoates PFIZER INC. (US) 1990-10-23 US disclosed
EP-0379288-A1 Process and intermediates for isopropyl 3S-amino-2R-hydroxyalkanoates PFIZER INC. (US) 1990-07-25 EP disclosed