SCHEMBL7995904

SCHEMBL7995904

O=C(O)/C=C\c1ccc2c(c1)OCO2

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.81
CYP1A2 P05177 2/20 0.79
HSD17B10 Q99714 2/20 0.79
ALDH1A1 P00352 4/20 0.68
TRPM8 Q7Z2W7 2/20 0.65
MAOB P27338 3/20 0.64
MAPT P10636 4/20 0.62
RAB9A P51151 3/20 0.62
CYP2D6 P10635 2/20 0.62
NPC1 O15118 2/20 0.62
CYP3A4 P08684 2/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
TRPV1 Q8NER1 1/20 0.62
CYP1A1 P04798 1/20 0.62
CYP1B1 Q16678 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
HPGD P15428 4/20 0.61
POLB P06746 1/20 0.61
HDAC6 Q9UBN7 1/20 0.60

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
SCHEMBL79427 1.00 KDM4E (0.81) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
SCHEMBL4745286 1.00 KDM4E (0.81) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
SCHEMBL29644896 1.00 KDM4E (0.81) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
SCHEMBL29690600 1.00 KDM4E (0.81) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
SCHEMBL4745288 1.00 KDM4E (0.81) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
SCHEMBL79428 1.00 KDM4E (0.81) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
Hydrochloric Acid SCHEMBL6821836 0.98 KDM4E (0.79) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
Hydrochloric Acid SCHEMBL27927566 0.98 KDM4E (0.79) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
Pyrrolidine SCHEMBL28573157 0.91 KDM4E (0.68) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8
SCHEMBL10467644 0.91 CYP1A2 (0.71) KDM4ECYP1A2HSD17B10ALDH1A1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118272274-B Lactic acid bacteria starter and application thereof in preparation of blueberry corn peptide fermentation liquor 齐齐哈尔大学 2024-08-09 CN disclosed
CN-118272274-A Lactic acid bacteria starter and application thereof in preparation of blueberry corn peptide fermentation liquor 齐齐哈尔大学 2024-07-02 CN disclosed
EP-0975224-A1 PROCESS AND COMPOSITIONS FOR ENHANCING RELIABILITY OF EXOGENOUS CHEMICAL SUBSTANCES APPLIED TO PLANTS MONSANTO COMPANY (US) 2000-02-02 EP disclosed
US-6020287-A USING MIXTURE OF HERBICIDE AND PHENYL-SUBSTITUTED OLEFIN COMPOUND MONSANTO COMPANY (US) 2000-02-01 US disclosed
WO-1998033385-A1 PROCESS AND COMPOSITIONS FOR ENHANCING RELIABILITY OF EXOGENOUS CHEMICAL SUBSTANCES APPLIED TO PLANTS MONSANTO COMPANY (US) 1998-08-06 WO disclosed