SCHEMBL8680546

SCHEMBL8680546

CCCCOC(C)(OCCCC)C(CCC(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.39
BLM P54132 1/20 0.39
HSPE1 P61604 1/20 0.39
AKR1B1 P15121 1/20 0.38
CA2 P00918 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPT P10636 1/20 0.38
FFAR4 Q5NUL3 2/20 0.38
FFAR1 O14842 2/20 0.38
PLA2G2C Q5R387 1/20 0.38
GPR84 Q9NQS5 7/20 0.37
PPARG P37231 6/20 0.37
PPARD Q03181 6/20 0.37
PPARA Q07869 6/20 0.37
HDAC11 Q96DB2 5/20 0.37
TSHR P16473 4/20 0.37
ALDH1A1 P00352 2/20 0.37
TLR2 O60603 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
FABP4 P15090 2/20 0.37

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
SCHEMBL2898687 0.92 AKR1B1 (0.41) HSPD1BLMHSPE1AKR1B1FFAR4
SCHEMBL8680834 0.89 FFAR4 (0.49) HSPD1BLMHSPE1AKR1B1MAPT
SCHEMBL7987396 0.88 HSPD1 (0.38) HSPD1BLMHSPE1AKR1B1FFAR4
SCHEMBL8023993 0.83 HSPD1 (0.37) HSPD1BLMHSPE1CA2MAPK1
SCHEMBL2469627 0.78 HSPD1 (0.35) HSPD1BLMHSPE1AKR1B1MAPT
SCHEMBL9749309 0.77 FOLH1 (0.39) HSPD1BLMHSPE1AKR1B1FFAR4
SCHEMBL28511643 0.75 HSPD1 (0.40) HSPD1BLMHSPE1AKR1B1MAPT
SCHEMBL8845925 0.75 HSPD1 (0.35) HSPD1BLMHSPE1AKR1B1MAPT
SCHEMBL27735886 0.74 FFAR4 (0.45) HSPD1BLMHSPE1FFAR4FFAR1
SCHEMBL2469625 0.74 HSPD1 (0.32) HSPD1BLMHSPE1AKR1B1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5795695-A PHOTO-QUALITY RECORDING XEROX CORPORATION (US) 1998-08-18 US claimed