SCHEMBL672668

SCHEMBL672668

CC1(C)CCc2cccc(C(=O)O)c2O1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
PKM P14618 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SSTR5 P35346 1/20 0.43
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
PARP1 P09874 1/20 0.41
TSHR P16473 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
HPGD P15428 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALOX15 P16050 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
SCHEMBL7332583 0.91 LMNA (0.42) LMNAPKMNPSR1SSTR5ALDH1A1
SCHEMBL11257227 0.88 LMNA (0.47) LMNAPKMNPSR1SSTR5ALDH1A1
SCHEMBL6171975 0.86 PARP1 (0.58) LMNAPKMNPSR1SSTR5ALDH1A1
SCHEMBL783714 0.84 LMNA (0.59) LMNAPKMNPSR1ALDH1A1KDM4E
SCHEMBL673400 0.84 LMNA (0.44) LMNAPKMNPSR1ALDH1A1KDM4E
SCHEMBL9749197 0.77 SSTR5 (0.37) LMNASSTR5HPGD
SCHEMBL2548565 0.75 LMNA (0.44) LMNAPKMNPSR1ALDH1A1KDM4E
SCHEMBL15625037 0.75 PKM (0.39) LMNAPKMNPSR1ALDH1A1KDM4E
SCHEMBL11223734 0.75 IDO1 (0.39) LMNAPKMNPSR1SSTR5ALDH1A1
SCHEMBL14907126 0.74 CCR5 (0.38) SSTR5MAPTTSHRHPGD

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0784620-A1 N-SUBSTITUTED PIPERIDINYL BICYCLIC BENZOATE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1997-07-23 EP claimed
WO-1996010027-A1 N-SUBSTITUTED PIPERIDINYL BICYCLIC BENZOATE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1996-04-04 WO claimed
CN-107660148-A Compounds for preventing or treating organ damage 萨尔法泰克有限公司 2018-02-02 CN disclosed
EP-2605658-B1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME (US) 2016-03-23 EP disclosed
EP-2935232-A1 COMPOUNDS FOR PROTECTION OF CELLS Sulfateq B.V. (NL) 2015-10-28 EP disclosed
EP-2582674-B1 GPR120 RECEPTOR AGONISTS AND USES THEREOF CYMABAY THERAPEUTICS INC (US) 2014-10-01 EP disclosed
WO-2014098586-A1 COMPOUNDS FOR PROTECTION OF CELLS SULFATEQ B.V. (NL) 2014-06-26 WO disclosed
US-8742110-B2 Spiroxazolidinone compounds MERCK SHARP & DOHME CORP. (US) 2014-06-03 US disclosed
US-8476308-B2 GPR120 receptor agonists and uses thereof METABOLEX, INC. (US) 2013-07-02 US disclosed
US-8476308-B2 GPR120 receptor agonists and uses thereof METABOLEX, INC. (US) 2013-07-02 US disclosed
EP-2605658-A1 SPIROXAZOLIDINONE COMPOUNDS Merck Sharp & Dohme Corp. (US) 2013-06-26 EP disclosed
EP-0307172-B1 Improvements in or relating to specific 5-HT3 antagonists LILLY CO ELI (US) 1995-10-11 EP disclosed
US-5442078-A Intermediates for specific 5-HT3 antagonists ELI LILLY AND COMPANY (US) 1995-08-15 US disclosed
EP-0625149-A1 BENZOPYRAN, BENZOTHIOPYRAN AND BENZOFURAN DERIVATIVES AS 5-HT4 ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-11-23 EP disclosed
US-5364863-A Treatment of migraine, emesis, schizophrenia, anxiety, gastrointestinal disorders ELI LILLY AND COMPANY (US) 1994-11-15 US disclosed
WO-1993016072-A1 BENZOPYRAN, BENZOTHIOPYRAN AND BENZOFURAN DERIVATIVES AS 5-HT4 ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1993-08-19 WO disclosed
US-4997956-A Analgesics ELI LILLY AND COMPANY (US) 1991-03-05 US disclosed
US-4921982-A 5-halo-2,3-dihydro-2,2-dimethylbenzofuran-7-carboxylic acids useful as intermediates for 5-HT3 antagonists ELI LILLY AND COMPANY (US) 1990-05-01 US disclosed
EP-0307172-A2 Improvements in or relating to specific 5-HT3 antagonists ELI LILLY AND COMPANY (US) 1989-03-15 EP disclosed
US-4329459-A ENDOPEROXIDE CYCLOXGENASE INHIBITORS THE UPJOHN COMPANY (US) 1982-05-11 US disclosed