SCHEMBL5522601

SCHEMBL5522601

C=C(C)COC(C)c1c(C(=O)O)ccc(C(=O)O)c1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
EED O75530 1/20 0.32
RBBP4 Q09028 1/20 0.32
SUZ12 Q15022 1/20 0.32
EZH2 Q15910 1/20 0.32
AEBP2 Q6ZN18 1/20 0.32
GPR174 Q9BXC1 1/20 0.31
GRM1 Q13255 1/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL242493 0.92 ALDH1A1 (0.31) ALDH1A1EEDRBBP4SUZ12EZH2
SCHEMBL2464291 0.79 ALDH1A1 (0.30) ALDH1A1
SCHEMBL5522604 0.78 ALDH1A1 (0.35) ALDH1A1POLBKDM4E
SCHEMBL9843284 0.74 CA12 (0.40) ALDH1A1GRM1POLBKDM4EHSD17B10
SCHEMBL4578643 0.72 MAPK1 (0.38) ALDH1A1KDM4EHSD17B10
SCHEMBL17797855 0.72 ALDH1A1 (0.35) ALDH1A1GRM1POLBKDM4EHSD17B10
SCHEMBL5175650 0.72 HCAR2 (0.36) ALDH1A1
SCHEMBL17797916 0.72 ALDH1A1 (0.35) ALDH1A1GRM1POLBKDM4EHSD17B10
SCHEMBL28238364 0.71 CYP1A2 (0.42) ALDH1A1GRM1HSD17B10
SCHEMBL3270892 0.71 SLC37A4 (0.32)

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
WO-2007064152-A1 INJECTABLE THERMOSENSITIVE PLURONIC HYDROGELS COUPLED WITH BIOACTIVE MATERIALS FOR TISSUE REGENERATION AND PREPARATION MEHTOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2007-06-07 WO claimed
EP-0252603-A2 Adhesives for ceramics and processes for the bonding of ceramics using same MITSUI SEKIYU KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-01-13 EP claimed
CN-112513175-B Fluoropolymer-containing composition and molded article 大金工业株式会社 2023-02-21 CN disclosed
WO-2021160788-A1 METHODS FOR REDUCING OR PREVENTING COLLOIDS ADHESION AND/OR FOULING ON DIFFERENT SUBSTRATES, COMPOSITIONS, AND COPOLYMERS USEFUL THEREFOR SOLVAY SA (BE) 2021-08-19 WO disclosed
WO-2007064152-A1 INJECTABLE THERMOSENSITIVE PLURONIC HYDROGELS COUPLED WITH BIOACTIVE MATERIALS FOR TISSUE REGENERATION AND PREPARATION MEHTOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2007-06-07 WO disclosed