SCHEMBL8418481

SCHEMBL8418481

C=CCc1cc(CCC(=O)O)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.53
GABRB2 P47870 4/20 0.53
POLB P06746 2/20 0.50
MEN1 O00255 2/20 0.50
GAA P10253 2/20 0.50
MAPT P10636 2/20 0.50
CNR1 P21554 2/20 0.50
CNR2 P34972 2/20 0.50
KMT2A Q03164 2/20 0.50
ALOX5 P09917 1/20 0.50
GABRB1 P18505 1/20 0.50
RXRA P19793 1/20 0.50
GABRA5 P31644 1/20 0.50
GABRA3 P34903 1/20 0.50
GABRA2 P47869 1/20 0.50
ACE2 Q9BYF1 1/20 0.50
SIRT3 Q9NTG7 1/20 0.50
XDH P47989 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45

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
SCHEMBL8418563 0.86 GABRA1 (0.51) GABRA1GABRB2POLBMEN1GAA
SCHEMBL8418501 0.86 GABRA1 (0.51) GABRA1GABRB2POLBMEN1GAA
SCHEMBL20840187 0.85 GABRA1 (0.66) GABRA1GABRB2POLBMEN1GAA
SCHEMBL8422007 0.84 GAA (0.58) GABRA1GABRB2POLBMEN1GAA
SCHEMBL9573740 0.82 IAPP (0.64) GABRA1GABRB2POLBMEN1GAA
SCHEMBL4889219 0.82 GABRA1 (0.47) GABRA1GABRB2POLBMEN1GAA
SCHEMBL7937253 0.82 KEAP1 (0.41) GABRA1GABRB2KDM4ENPSR1FFAR1
SCHEMBL9436388 0.82 GABRA1 (0.61) GABRA1GABRB2POLBMEN1GAA
SCHEMBL31296398 0.81 BACE1 (0.42) POLBNPSR1FFAR1EGFRLCK
SCHEMBL8418573 0.80 FDFT1 (0.52) GABRA1GABRB2POLBMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117263821-A Mono-alicyclic diamide hindered phenol antioxidant and preparation method thereof 西华大学 2023-12-22 CN claimed
CN-110914327-B Color stable curing composition of polyisocyanates containing alicyclic diisocyanates 巴斯夫欧洲公司 2023-08-22 CN claimed
EP-3655456-A1 COLOUR-STABLE CURING COMPOSITIONS CONTAINING POLYISOCYANATE (CYCLO)ALIPHATIC DIISOCYANATES BASF SE (DE) 2020-05-27 EP claimed
CN-110914327-A Color-stable curing compositions comprising polyisocyanates of (cyclo) aliphatic diisocyanates 巴斯夫欧洲公司 2020-03-24 CN claimed
CN-117263821-A Mono-alicyclic diamide hindered phenol antioxidant and preparation method thereof 西华大学 2023-12-22 CN disclosed
CN-117263821-A Mono-alicyclic diamide hindered phenol antioxidant and preparation method thereof 西华大学 2023-12-22 CN disclosed
CN-110914327-B Color stable curing composition of polyisocyanates containing alicyclic diisocyanates 巴斯夫欧洲公司 2023-08-22 CN disclosed
CN-113784989-A Complex polypeptides with metal binding regions and molecular constructs thereof 免疫功坊股份有限公司 2021-12-10 CN disclosed
EP-3655456-A1 COLOUR-STABLE CURING COMPOSITIONS CONTAINING POLYISOCYANATE (CYCLO)ALIPHATIC DIISOCYANATES BASF SE (DE) 2020-05-27 EP disclosed
CN-110914327-A Color-stable curing compositions comprising polyisocyanates of (cyclo) aliphatic diisocyanates 巴斯夫欧洲公司 2020-03-24 CN disclosed
US-5919793-A QUINUCLIDINE DERIVATIVES, SQUALENE SYNTHETASE INHIBITORS, ANTICHOLESTEROL AGENTS ZENECA LIMITED (GB) 1999-07-06 US disclosed
CN-1121718-A Heterocyclic derivatives ZENECA LTD (GB) 1996-05-01 CN disclosed
EP-0696284-A1 HETEROCYCLIC DERIVATIVES ZENECA LIMITED (GB) 1996-02-14 EP disclosed
WO-1995035295-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1995-12-28 WO disclosed
WO-1994025459-A1 HETEROCYCLIC DERIVATIVES ZENECA LIMITED (GB) 1994-11-10 WO disclosed