SCHEMBL8018732

SCHEMBL8018732

CCC(CO)CCCC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.58
▸ GSTK1 Q9Y2Q3 2/20 0.50
▸ AKR1B1 P15121 1/20 0.44
▸ GPR84 Q9NQS5 7/20 0.43
▸ PPARG P37231 7/20 0.43
▸ PPARD Q03181 7/20 0.43
▸ PPARA Q07869 7/20 0.43
▸ HDAC11 Q96DB2 5/20 0.43
▸ TSHR P16473 4/20 0.43
▸ PTPN1 P18031 3/20 0.43
▸ TLR2 O60603 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ FABP4 P15090 2/20 0.43
▸ FFAR1 O14842 2/20 0.43
▸ FFAR4 Q5NUL3 2/20 0.43
▸ SLC22A6 Q4U2R8 1/20 0.43
▸ SLC22A8 Q8TCC7 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ ALOX15 P16050 1/20 0.43

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
SCHEMBL4294934 0.94 ALDH1A1 (0.56) ALDH1A1GSTK1AKR1B1GPR84PPARG
SCHEMBL10698108 0.92 GSTK1 (0.55) ALDH1A1GSTK1GPR84PPARGPPARD
SCHEMBL17062986 0.92 GSTK1 (0.55) ALDH1A1GSTK1GPR84PPARGPPARD
Adipic Acid SCHEMBL17817818 0.90 ALDH1A1 (0.69) ALDH1A1AKR1B1GPR84PPARGPPARD
SCHEMBL14360224 0.89 GSTK1 (0.56) ALDH1A1GSTK1AKR1B1GPR84PPARG
SCHEMBL2696820 0.89 GSTK1 (0.56) ALDH1A1GSTK1AKR1B1GPR84PPARG
Azelaic Acid SCHEMBL18043679 0.88 ALDH1A1 (0.67) ALDH1A1AKR1B1GPR84PPARGPPARD
Sebacic Acid SCHEMBL17817821 0.88 ALDH1A1 (0.67) ALDH1A1AKR1B1GPR84PPARGPPARD
Sebacic Acid SCHEMBL30542922 0.88 ALDH1A1 (0.67) ALDH1A1AKR1B1GPR84PPARGPPARD
Succinic Acid SCHEMBL27940053 0.88 ALDH1A1 (0.72) ALDH1A1AKR1B1GPR84PPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106604966-B Polyester and resin composition and preparation method thereof SK化学株式会社 2018-11-13 — — CN disclosed
US-9884515-B2 Tire BRIDGESTONE CORPORATION (JP) 2018-02-06 — — US disclosed
EP-2962869-B1 TIRE BRIDGESTONE CORP (JP) 2018-01-31 — — EP disclosed
CN-107074859-A Indoleamine 2, the diaza and three aza-tricycle compounds of the cyclohexyl-ethyl substitution of 3 dioxygenases (IDO) antagonist are used as treating cancer 默克专利有限公司 2017-08-18 — — CN disclosed
CN-105849073-A Method for producing at least one hydroxymethylcyclohexane compound 伊士曼化工公司 2016-08-10 — — CN disclosed
CN-103687833-B The method preparing 1,4 cyclohexane dimethanol 伊士曼化工公司 2016-06-29 — — CN disclosed
CN-103687832-B The integrated process of 1,4 cyclohexane dimethanol is prepared by p-phthalic acid 伊士曼化工公司 2016-06-29 — — CN disclosed
US-20160001598-A1 TIRE BRIDGESTONE CORPORATION (JP) 2016-01-07 — — US disclosed
EP-2962869-A1 TIRE Bridgestone Corporation (JP) 2016-01-06 — — EP disclosed
EP-0983220-A1 METHOD FOR PRODUCING ALCOHOLS CONTAINING CYCLOALIPHATIC GROUPS BASF AKTIENGESELLSCHAFT (DE) 2000-03-08 — — EP disclosed
WO-1998052892-A1 METHOD FOR PRODUCING ALCOHOLS CONTAINING CYCLOALIPHATIC GROUPS BASF AKTIENGESELLSCHAFT (DE) 1998-11-26 — — WO disclosed
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