SCHEMBL8897760

SCHEMBL8897760

CCC(=O)CCCCCCCC(C)(C)CC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.43
FFAR1 O14842 1/20 0.43
CPT2 P23786 1/20 0.43
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 2/20 0.34
HAO1 Q9UJM8 1/20 0.34
CES1 P23141 8/20 0.33
CES2 O00748 5/20 0.33
FAAH O00519 7/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL12848582 1.00 TDP1 (0.43) TDP1FFAR1CPT2KMT2AMAPT
SCHEMBL8898451 0.91 TDP1 (0.39) TDP1FFAR1CPT2KMT2AMAPT
SCHEMBL8897919 0.86 KMT2A (0.45) TDP1FFAR1CPT2KMT2AMAPT
SCHEMBL8897286 0.86 KMT2A (0.50) TDP1FFAR1CPT2KMT2AMAPT
SCHEMBL8898593 0.86 KMT2A (0.45) TDP1FFAR1CPT2KMT2AMAPT
SCHEMBL25479027 0.86 TDP1 (0.42) TDP1FFAR1CPT2KMT2AMAPT
SCHEMBL12909424 0.84 FFAR1 (0.41) TDP1FFAR1CPT2KMT2AMAPT
SCHEMBL13302049 0.84 FFAR1 (0.41) TDP1FFAR1CPT2KMT2AMAPT
SCHEMBL8896365 0.83 KMT2A (0.52) TDP1FFAR1KMT2AMAPTALDH1A1
SCHEMBL8897931 0.83 KMT2A (0.40) TDP1FFAR1CPT2KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0531715-B1 Process for producing alcohols and ketones SUMITOMO CHEMICAL CO (JP) 1997-11-05 EP disclosed
US-5426237-A Oxidation of straight, branched or cyclic alkanes and benzene derivatives in presence of transition metal catalyst and aldehyde SUMITOMO CHEMICAL CO., LTD. (JP) 1995-06-20 US disclosed
EP-0531715-A1 Process for producing alcohols and ketones SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-17 EP disclosed