SCHEMBL6512170

SCHEMBL6512170

O=C(O)CCC[C@H](O)c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 3/20 0.50
FOLH1 Q04609 4/20 0.48
LMNA P02545 1/20 0.45
AOC3 Q16853 1/20 0.43
SLC18A3 Q16572 1/20 0.42
PTGER2 P43116 1/20 0.41
PTGER1 P34995 1/20 0.41
PTGFR P43088 1/20 0.41

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
SCHEMBL27868603 1.00 TBXA2R (0.50) TBXA2RFOLH1LMNAAOC3SLC18A3
SCHEMBL2743522 1.00 TBXA2R (0.50) TBXA2RFOLH1LMNAAOC3SLC18A3
SCHEMBL8743003 0.93 TBXA2R (0.58) TBXA2RPTGER2PTGER1PTGFR
SCHEMBL8742992 0.93 TBXA2R (0.58) TBXA2RPTGER2PTGER1PTGFR
SCHEMBL21358345 0.91 FOLH1 (0.46) TBXA2RFOLH1AOC3
SCHEMBL641514 0.91 FOLH1 (0.46) TBXA2RFOLH1AOC3
SCHEMBL67079 0.87 TBXA2R (0.58) TBXA2RFOLH1LMNA
SCHEMBL11756883 0.86 FFAR1 (0.48) TBXA2RFOLH1AOC3
SCHEMBL4311004 0.85 AOC3 (0.47) AOC3
SCHEMBL28412576 0.84 NPC1 (0.41) TBXA2RFOLH1PTGER1PTGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103849574-B Candida parapsilosis ZJPH1305 and the application in chiral alcohol preparation JIANG University OF TECHNOLOGY (CN) 2016-03-02 CN claimed
CN-103849574-A Candida parapsilosis ZJPH1305 and application thereof in preparation of chiral alcohol UNIV ZHEJIANG TECHNOLOGY 2014-06-11 CN claimed
US-9994520-B2 Enzymatic process for the preparation of (S)-5-(4-fluoro-phenyl)-5-hydroxy-1morpholin-4-yl-pentan-1-one, an intermediate of ezetimibe and further conversion to ezetimibe MYLAN LABORATORIES LIMITED (IN) 2018-06-12 US disclosed
CN-103849574-B Candida parapsilosis ZJPH1305 and the application in chiral alcohol preparation JIANG University OF TECHNOLOGY (CN) 2016-03-02 CN disclosed
CN-103849574-B Candida parapsilosis ZJPH1305 and the application in chiral alcohol preparation JIANG University OF TECHNOLOGY (CN) 2016-03-02 CN disclosed
CN-103896700-B The preparation method of ezetimibe chiral intermediate ZHEJIANG JIUZHOU PHARMACEUTICAL TECHNOLOGY CO., LTD. (CN) 2015-12-23 CN disclosed
CN-103896700-A Preparation method of ezetimibe chiral intermediate ZHEJIANG JIUZHOU PHARMACEUTICAL TECHNOLOGY CO LTD 2014-07-02 CN disclosed
CN-103849574-A Candida parapsilosis ZJPH1305 and application thereof in preparation of chiral alcohol UNIV ZHEJIANG TECHNOLOGY 2014-06-11 CN disclosed
CN-102605034-B Biological enzyme resolution method for preparing optically pure (S)-5-(4-fluorophenyl)-5-hydroxypentanoate CHONGQING HUIJIAN BIOLOG TECHNOLOGY CO LTD 2014-05-14 CN disclosed
CN-102605034-B Biological enzyme resolution method for preparing optically pure (S)-5-(4-fluorophenyl)-5-hydroxypentanoate CHONGQING HUIJIAN BIOLOG TECHNOLOGY CO LTD 2014-05-14 CN disclosed
CN-102605034-B Biological enzyme resolution method for preparing optically pure (S)-5-(4-fluorophenyl)-5-hydroxypentanoate CHONGQING HUIJIAN BIOLOG TECHNOLOGY CO LTD 2014-05-14 CN disclosed
CN-102605034-A Biological enzyme resolution method for preparing optically pure (S)-5-(4-fluorophenyl)-5-hydroxypentanoate CHONGQING HUIJIAN BIOLOG TECHNOLOGY CO LTD 2012-07-25 CN disclosed
CN-102605034-A Biological enzyme resolution method for preparing optically pure (S)-5-(4-fluorophenyl)-5-hydroxypentanoate CHONGQING HUIJIAN BIOLOG TECHNOLOGY CO LTD 2012-07-25 CN disclosed
WO-2005066120-A2 PROCESS FOR ASYMMETRIC SYNTHESIS OF HYDROXY-ALKYL SUBSTITUTED AZETIDINONE DERIVATIVES RANBAXY LABORATORIES LIMITED (IN) 2005-07-21 WO disclosed
US-6906063-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2005-06-14 US disclosed
EP-0862645-B1 STEREOSELECTIVE MICROBIAL REDUCTION PROCESS SCHERING CORP (US) 2003-02-05 EP disclosed
US-20020077486-A1 For therapy and prophylaxis of thrombosis in a mammal ALEXION PHARMACEUTICALS, INC. 2002-06-20 US disclosed
EP-0862645-A1 STEREOSELECTIVE MICROBIAL REDUCTION PROCESS SCHERING CORPORATION (US) 1998-09-09 EP disclosed
US-5618707-A CHEMICAL INTERMEDIATE FOR ANTICHOLESTEROL AGENT SCHERING CORPORATION (US) 1997-04-08 US disclosed
WO-1997012053-A1 STEREOSELECTIVE MICROBIAL REDUCTION PROCESS SCHERING CORPORATION (US) 1997-04-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020077486-A1 For therapy and prophylaxis of thrombosis in a mammal PIGS, TBXA2R, GP6 TBXA2R 2/4885FOLH1 2475/4885LMNA 2940/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.