SCHEMBL9749309

SCHEMBL9749309

CCOC(C)(OCC)C(CCCC(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.39
HSPD1 P10809 1/20 0.37
BLM P54132 1/20 0.37
HSPE1 P61604 1/20 0.37
AKR1B1 P15121 1/20 0.36
FFAR4 Q5NUL3 2/20 0.36
FFAR1 O14842 2/20 0.36
GPR84 Q9NQS5 7/20 0.35
PPARG P37231 6/20 0.35
PPARD Q03181 6/20 0.35
PPARA Q07869 6/20 0.35
HDAC11 Q96DB2 5/20 0.35
TSHR P16473 4/20 0.35
TET2 Q6N021 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TLR2 O60603 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
FABP4 P15090 2/20 0.35
PTPN1 P18031 2/20 0.35
KDM4A O75164 2/20 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
SCHEMBL27735886 0.93 FFAR4 (0.45) HSPD1BLMHSPE1FFAR4FFAR1
SCHEMBL7987396 0.91 HSPD1 (0.38) HSPD1BLMHSPE1AKR1B1FFAR4
SCHEMBL2898687 0.85 AKR1B1 (0.41) HSPD1BLMHSPE1AKR1B1FFAR4
SCHEMBL1967834 0.82 FOLH1 (0.41) FOLH1HSPD1BLMHSPE1TSHR
SCHEMBL7555101 0.80 FOLH1 (0.42) FOLH1HSPD1BLMHSPE1AKR1B1
SCHEMBL8680834 0.80 FFAR4 (0.49) HSPD1BLMHSPE1AKR1B1FFAR4
SCHEMBL3989536 0.78 TDP1 (0.34) HSPD1BLMHSPE1ALDH1A1TDP1
SCHEMBL9556833 0.77 FOLH1 (0.46) FOLH1HSPD1BLMHSPE1AKR1B1
SCHEMBL5611416 0.77 FOLH1 (0.46) FOLH1HSPD1BLMHSPE1AKR1B1
SCHEMBL8680546 0.77 HSPD1 (0.39) HSPD1BLMHSPE1AKR1B1FFAR4

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-2020226147-A1 GEL-TYPE EXTERNAL COMPOSITION FOR SKIN 株式会社林原 2020-11-12 WO claimed
EP-0217380-B1 METHOD FOR THE PREPARATION OF BINDING AGENTS FOR PAINTS AND PLASTERS WACKER-CHEMIE GMBH (DE) 1992-01-22 EP disclosed
EP-0217380-A2 Method for the preparation of binding agents for paints and plasters WACKER-CHEMIE GMBH (DE) 1987-04-08 EP disclosed
EP-0076511-B1 PROCESS TO PRODUCE AN AQUEOUS COPOLYMER DISPERSIONS, AND THEIR UTILISATION Wacker-Chemie GmbH (DE) 1986-01-15 EP disclosed
EP-0076511-A2 Process to produce an aqueous copolymer dispersions, and their utilisation Wacker-Chemie GmbH (DE) 1983-04-13 EP disclosed