SCHEMBL697581

SCHEMBL697581

Cc1ccccc1C(O)(C(=O)O)C(O)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 1/20 0.35
ACLY P53396 1/20 0.35
LMNA P02545 2/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C9 P11712 2/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HPGD P15428 1/20 0.33
CYP2D6 P10635 2/20 0.33
HIF1A Q16665 1/20 0.33
CYP1A2 P05177 1/20 0.33
GAA P10253 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ATM Q13315 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CASR P41180 1/20 0.32

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
SCHEMBL12817104 1.00 CPT2 (0.35) CPT2ACLYLMNAMAPK1CYP2C9
Water SCHEMBL28155256 0.98 CPT2 (0.34) CPT2ACLYLMNAMAPK1CYP2C9
SCHEMBL27524735 0.92 SLC1A3 (0.36) LMNAMAPTKMT2AL3MBTL1HPGD
SCHEMBL30628107 0.87 TRPA1 (0.37) CPT2ACLYLMNACYP2C9MEN1
SCHEMBL30628124 0.87 TRPA1 (0.37) CPT2ACLYLMNACYP2C9MEN1
SCHEMBL29092511 0.87 TRPA1 (0.37) CPT2ACLYLMNACYP2C9MEN1
SCHEMBL16795793 0.81 GABRA1 (0.36) LMNAMAPK1MAPTL3MBTL1HPGD
SCHEMBL15538386 0.81 GABRA1 (0.36) LMNAMAPK1MAPTL3MBTL1HPGD
SCHEMBL15539622 0.81 GABRA1 (0.36) LMNAMAPK1MAPTL3MBTL1HPGD
SCHEMBL5310850 0.81 ATM (0.38) L3MBTL1CYP1A2GAAKDM4EALDH1A1

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 1140 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4479546-A2 PROCESSES FOR PREPARATION OF AVACOPAN AND INTERMEDIATES THEREOF Teva Pharmaceuticals International GmbH (CH) 2024-12-25 EP claimed
WO-2023158722-A2 PROCESSES FOR PREPARATION OF AVACOPAN AND INTERMEDIATES THEREOF TEVA PHARMACEUTICALS INTERNATIONAL GMBH (CH) 2023-08-24 WO claimed
CN-110452258-A A kind of preparation method of dipeptides valine Boroproline salt BALMXY PHARMACEUTIC CO LTD 2019-11-15 CN claimed
CN-106543119-B Preparation method of optically pure tasimelteon 浙江工业大学 2019-07-26 CN claimed
CN-109988083-A The preparation method of high-optical-purity escitalopram oxalate intermediate S configuration glycol 北京哈三联科技有限责任公司 2019-07-09 CN claimed
CN-106831538-B The preparation method of tropsch imatinib intermediate 苏州楚凯药业有限公司 2019-06-25 CN claimed
CN-108440388-B The preparation method of one kind (S) -4- ((the bromo- 6- fluorophenyl of 2-) hydroxymethyl) piperidines -1- t-butyl formate 上海再启生物技术有限公司 2019-06-11 CN claimed
CN-109810047-A (R) synthetic method of the chiral intermediate of -3- Phenylpiperidine or/and (S) -3- Phenylpiperidine and Ni Lapani 上海博邦医药科技有限公司 2019-05-28 CN claimed
CN-106432199-B A kind of preparation process of optical voidness Ondansetron and its salt derivative 南昌市博泽康医药科技有限公司 2019-04-26 CN claimed
CN-109207088-A A kind of preparation method of the photosensitive adhesive of PTC function 合肥萃励新材料科技有限公司 2019-01-15 CN claimed
CN-106053647-A Method for detecting sparfloxacin enantiomer in aquatic product 浙江海洋大学 2016-10-26 CN claimed
CN-105987970-A Method for detecting flumequine enantiomer in human plasma 浙江海洋大学 2016-10-05 CN claimed
CN-105693606-A Asymmetric synthesis method of optically pure (R)/(S)-hydroxychloroquine 西安科技大学 2016-06-22 CN claimed
CN-105693605-A Asymmetric synthesis method of optically pure (R)/(S)-chloroquine 西安科技大学 2016-06-22 CN claimed
WO-2015063795-A2 NOVEL PROCESS FOR PREPARATION OF OPTICALLY PURE NOREPHEDRINE AND ITS DERIVATIVES LAURUS LABS PRIVATE LIMITED (IN) 2015-05-07 WO claimed
EP-2231582-B1 PROCESS FOR THE SYNTHESIS OF PROPARGYLATED AMINOINDAN DERIVATIVES CIPLA LTD (IN) 2011-06-22 EP claimed
EP-2231582-A1 PROCESS FOR THE SYNTHESIS OF PROPARGYLATED AMINOINDAN DERIVATIVES Cipla Limited (IN) 2010-09-29 EP claimed
WO-2009147687-A2 AN IMPROVED PROCESS FOR THE SEPARATION OF ENANTIOMERICALLY PURE COMPOUNDS SHODHANA LABORATORIES LIMITED (IN) 2009-12-10 WO claimed
WO-2009081148-A1 PROCESS FOR THE SYNTHESIS OF PROPARGYLATED AMINOINDAN DERIVATIVES CIPLA LIMITED (IN) 2009-07-02 WO claimed
WO-2009019719-A2 PROCESS FOR THE PREPARATION OF 3-ARYLOXY-3-ARYLPROPANAMINES IND-SWIFT LABORATORIES LIMITED (IN) 2009-02-12 WO claimed