SCHEMBL2432464

SCHEMBL2432464

CC(C)C/C=C(\C=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
ASF1A Q9Y294 1/20 0.39
NR1H4 Q96RI1 1/20 0.36
PGR P06401 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
HTR2A P28223 1/20 0.36
HRH1 P35367 1/20 0.36
KCNH2 Q12809 1/20 0.36
HPGD P15428 3/20 0.36
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 2/20 0.35
XBP1 P17861 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GRIK1 P39086 1/20 0.35
MTNR1A P48039 1/20 0.35

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
SCHEMBL891499 1.00 ALDH1A1 (0.41) ALDH1A1MAPK1TDP1ASF1ANR1H4
SCHEMBL891343 1.00 ALDH1A1 (0.41) ALDH1A1MAPK1TDP1ASF1ANR1H4
SCHEMBL28788617 0.81 AKT1 (0.39) ALDH1A1ASF1APGRADRA2AADRA2B
SCHEMBL27966885 0.81 TDP1 (0.41) ALDH1A1MAPK1TDP1NR1H4HPGD
SCHEMBL28788613 0.81 AKT1 (0.39) ALDH1A1ASF1APGRADRA2AADRA2B
SCHEMBL4722353 0.81 TSHR (0.40) ALDH1A1HTR2ASMN1; SMN2LMNAMEN1
SCHEMBL4722351 0.81 TSHR (0.40) ALDH1A1HTR2ASMN1; SMN2LMNAMEN1
SCHEMBL7427758 0.79 ASF1A (0.38) ALDH1A1TDP1ASF1APGRADRA2A
SCHEMBL7427754 0.79 ASF1A (0.38) ALDH1A1TDP1ASF1APGRADRA2A
SCHEMBL2171580 0.79 ALDH1A1 (0.45) ALDH1A1MAPK1TDP1PGRADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190021351-A1 FLAVOURED MILK PRODUCT Société des Produits Nestlé S.A. (CH) 2019-01-24 US claimed
EP-3393261-A1 FLAVOURED MILK PRODUCT Nestec S.A. (CH) 2018-10-31 EP claimed
WO-2017108861-A1 FLAVOURED MILK PRODUCT NESTEC S.A. (CH) 2017-06-29 WO claimed
EP-4695016-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2026-02-18 EP disclosed
WO-2024213507-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2024-10-17 WO disclosed
EP-4288022-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2023-12-13 EP disclosed
WO-2022167123-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2022-08-11 WO disclosed
US-20190021351-A1 FLAVOURED MILK PRODUCT Société des Produits Nestlé S.A. (CH) 2019-01-24 US disclosed
CN-109068671-A Flavor milk product 雀巢产品技术援助有限公司 2018-12-21 CN disclosed
EP-3393261-A1 FLAVOURED MILK PRODUCT Nestec S.A. (CH) 2018-10-31 EP disclosed
WO-2017108861-A1 FLAVOURED MILK PRODUCT NESTEC S.A. (CH) 2017-06-29 WO disclosed
CN-101528061-B Regulate its taste and local flavor by milk product bioconversion 雀巢产品技术援助有限公司 2016-11-09 CN disclosed
EP-2083639-B1 TASTE AND FLAVOUR MODULATION BY BIOTRANSFORMATION IN MILK PRODUCTS NESTEC SA (CH) 2016-04-06 EP disclosed
EP-2366293-B1 TASTE AND FLAVOUR MODULATION BY BIOTRANSFORMATION IN MILK PRODUCTS NESTEC SA (CH) 2016-01-20 EP disclosed
EP-1915913-B1 Taste and flavour modulation by biotransformation in milk products NESTEC SA (CH) 2015-11-18 EP disclosed
EP-2366293-A1 Taste and flavour modulation by biotransformation in milk products Nestec S.A. (CH) 2011-09-21 EP disclosed
EP-2083639-A1 TASTE AND FLAVOUR MODULATION BY BIOTRANSFORMATION IN MILK PRODUCTS NESTEC S.A. (CH) 2009-08-05 EP disclosed
WO-2008049581-A1 TASTE AND FLAVOUR MODULATION BY BIOTRANSFORMATION IN MILK PRODUCTS NESTEC S.A. (CH) 2008-05-02 WO disclosed
EP-1915913-A1 Taste and flavour modulation by biotransformation in milk products NESTEC S.A. (CH) 2008-04-30 EP disclosed