SCHEMBL626046

SCHEMBL626046

C=CC(=O)C=Cc1ccc(O)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.76
F3 P13726 2/20 0.76
HSD11B1 P28845 2/20 0.76
CYP2C9 P11712 2/20 0.76
CYP2D6 P10635 1/20 0.76
BACE1 P56817 2/20 0.63
GSK3B P49841 1/20 0.63
TLR9 Q9NR96 1/20 0.63
AKR1B1 P15121 3/20 0.61
ESR1 P03372 3/20 0.61
ESR2 Q92731 3/20 0.61
AKR1B10 O60218 2/20 0.61
CA12 O43570 2/20 0.61
CA1 P00915 2/20 0.61
CA2 P00918 2/20 0.61
CA7 P43166 2/20 0.61
CA9 Q16790 2/20 0.61
CA14 Q9ULX7 2/20 0.61
PKM P14618 2/20 0.61
CA3 P07451 1/20 0.61

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
SCHEMBL626045 1.00 TYR (0.76) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL2146080 0.87 TYR (1.00) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL2198475 0.87 TYR (1.00) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL3580956 0.87 TYR (1.00) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL4370894 0.85 TYR (0.95) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL4371653 0.85 TYR (0.95) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL10631270 0.85 TYR (0.95) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL4381938 0.85 TYR (0.95) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL4373677 0.85 TYR (0.95) TYRF3HSD11B1CYP2C9CYP2D6
SCHEMBL28453768 0.82 TYR (0.74) TYRF3HSD11B1CYP2C9CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118240337-A Mesogenic epoxy composition for encapsulation and preparation method thereof 珠海格力新材料有限公司 2024-06-25 CN claimed
CN-112159315-B Method for efficiently synthesizing 1, 5-di (4-hydroxyphenyl) -1, 4-pentadiene-3-ketone 南昌大学 2021-12-14 CN claimed
CN-112159315-A Method for efficiently synthesizing 1, 5-di (4-hydroxyphenyl) -1, 4-pentadiene-3-ketone 南昌大学 2021-01-01 CN claimed
CN-118240337-A Mesogenic epoxy composition for encapsulation and preparation method thereof 珠海格力新材料有限公司 2024-06-25 CN disclosed
CN-112159315-B Method for efficiently synthesizing 1, 5-di (4-hydroxyphenyl) -1, 4-pentadiene-3-ketone 南昌大学 2021-12-14 CN disclosed
CN-113398106-A MTOR-independent TFEB activators for autophagy enhancement and uses thereof 香港浸会大学 2021-09-17 CN disclosed
CN-112159315-A Method for efficiently synthesizing 1, 5-di (4-hydroxyphenyl) -1, 4-pentadiene-3-ketone 南昌大学 2021-01-01 CN disclosed
WO-2012021692-A1 CURCUMIN ANALOGS AND METHODS OF USE THEREOF RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2012-02-16 WO disclosed
US-4181807-A Polymerizable esters derived from a glycidyl ether of a phenolic unsaturated ketone CIBA-GEIGY CORPORATION (US) 1980-01-01 US disclosed