SCHEMBL28046135

SCHEMBL28046135

CC(C)(C)CCCCC(C(=O)O)C(C)(C)CC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.39
BLM P54132 1/20 0.39
HSPE1 P61604 1/20 0.39
ACACB O00763 1/20 0.38
ACACA Q13085 1/20 0.38
FFAR1 O14842 1/20 0.35
CPT2 P23786 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
FOLH1 Q04609 3/20 0.33
CA2 P00918 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL1069110 0.85 HSPD1 (0.39) HSPD1BLMHSPE1ACACBACACA
SCHEMBL28806780 0.81 ACACB (0.44) HSPD1BLMHSPE1ACACBACACA
SCHEMBL29170384 0.81 ACACB (0.44) HSPD1BLMHSPE1ACACBACACA
SCHEMBL284229 0.81 ACACB (0.32) ACACBACACA
SCHEMBL30549440 0.78 HSPD1 (0.37) HSPD1BLMHSPE1ACACBACACA
SCHEMBL15183510 0.76 ACACB (0.45) ACACBACACAFFAR1CPT2TDP1
SCHEMBL28976130 0.74 HSPD1 (0.54) HSPD1BLMHSPE1FFAR1MEN1
SCHEMBL15183512 0.74 ACACB (0.48) ACACBACACAFFAR1CPT2TDP1
SCHEMBL15183515 0.74 ACACB (0.48) ACACBACACAFFAR1CPT2TDP1
Ammonia Solution, Strong SCHEMBL28463035 0.73 HSPD1 (0.53) HSPD1BLMHSPE1FFAR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108136832-A Tire 株式会社普利司通 2018-06-08 CN disclosed
CN-107922687-A TIRE 株式会社普利司通 2018-04-17 CN disclosed
CN-107207803-A Tyre for vehicle wheels 株式会社普利司通 2017-09-26 CN disclosed
CN-102653616-B Propylene resin composition SUMITOMO CHEMICAL CO., LTD. (JP) 2016-02-03 CN disclosed