SCHEMBL8895814

SCHEMBL8895814

CCCCC(=O)CCCC(C)(C)CCCC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
CES1 P23141 6/20 0.44
CES2 O00748 5/20 0.44
ALDH1A1 P00352 3/20 0.41
TP53 P04637 1/20 0.41
CA1 P00915 1/20 0.39
IAPP P10997 2/20 0.37
FFAR1 O14842 1/20 0.37
CPT2 P23786 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HAO1 Q9UJM8 1/20 0.36
AKR1B1 P15121 1/20 0.36
FAAH O00519 1/20 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
SCHEMBL20076396 0.90 MAPT (0.41) MAPTKMT2ACES1CES2ALDH1A1
SCHEMBL8898144 0.87 KMT2A (0.52) MAPTKMT2ACES1CES2ALDH1A1
SCHEMBL8899335 0.87 KMT2A (0.47) MAPTKMT2ACES1CES2ALDH1A1
SCHEMBL28332249 0.84 MAPT (0.46) MAPTKMT2ACES1CES2ALDH1A1
SCHEMBL20076318 0.82 MAPT (0.47) MAPTKMT2ACES1CES2ALDH1A1
SCHEMBL7163007 0.82 AKR1B1 (0.58) MAPTKMT2AALDH1A1FFAR1CPT2
SCHEMBL8897286 0.81 KMT2A (0.50) MAPTKMT2ACES1CES2ALDH1A1
SCHEMBL8896237 0.81 KMT2A (0.55) MAPTKMT2ACES1CES2ALDH1A1
SCHEMBL8898593 0.81 KMT2A (0.45) MAPTKMT2ACES1CES2ALDH1A1
SCHEMBL8896591 0.81 KMT2A (0.45) MAPTKMT2ACES1CES2ALDH1A1

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