SCHEMBL614649

SCHEMBL614649

CCOC(=O)[C@H](O)CCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.56
MAPT P10636 1/20 0.51
MMP8 P22894 1/20 0.49
PIN1 Q13526 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
TDP1 Q9NUW8 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TSHR P16473 2/20 0.46
NPC1 O15118 1/20 0.46
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
LMNA P02545 2/20 0.46
POLB P06746 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HSD17B10 Q99714 1/20 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
SCHEMBL820513 1.00 SMN1; SMN2 (0.56) SMN1; SMN2MAPTMMP8PIN1L3MBTL1
SCHEMBL991355 1.00 SMN1; SMN2 (0.56) SMN1; SMN2MAPTMMP8PIN1L3MBTL1
SCHEMBL29610080 0.95 SMN1; SMN2 (0.52) SMN1; SMN2MAPTMMP8PIN1L3MBTL1
SCHEMBL9712036 0.94 SMN1; SMN2 (0.51) SMN1; SMN2MAPTMMP8PIN1L3MBTL1
SCHEMBL7411749 0.91 SMN1; SMN2 (0.57) SMN1; SMN2MAPTMMP8MEN1KMT2A
SCHEMBL7421239 0.91 SMN1; SMN2 (0.57) SMN1; SMN2MAPTMMP8MEN1KMT2A
SCHEMBL1859511 0.90 SMN1; SMN2 (0.50) SMN1; SMN2MAPTMMP8PIN1TDP1
SCHEMBL27496209 0.87 SMN1; SMN2 (0.46) SMN1; SMN2MAPTL3MBTL1TDP1PPARG
SCHEMBL8888971 0.87 LMNA (0.62) L3MBTL1PPARGPPARALMNAALDH1A1
SCHEMBL9395007 0.87 LMNA (0.49) SMN1; SMN2TDP1MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116143620-A Method for preparing R-2-hydroxy-4-phenylbutyric acid ethyl ester 台州爱申特科技有限公司 2023-05-23 CN claimed
CN-115851641-A Fusion enzyme for efficiently producing (R) -2-hydroxy-4-phenylbutyric ethyl butyrate and application thereof 浙江工业大学 2023-03-28 CN claimed
CN-115820622-A Double-enzyme self-assembly compound and application of compound in synthesizing (R) -2-hydroxy-4-phenylbutyrate 浙江工业大学 2023-03-21 CN claimed
CN-109929885-B Method for preparing ethyl gamma-2-hydroxy-4-phenylbutyrate by coupling extraction of enzyme membrane reactor 江苏惠利生物科技有限公司 2022-07-15 CN claimed
CN-110903177-B Method for preparing levo muscone 万华化学集团股份有限公司 2022-07-12 CN claimed
CN-114456063-A Method for preparing benazepril key intermediate R-2-hydroxy-4-phenylbutyric acid ethyl ester 南方科技大学台州研究院 2022-05-10 CN claimed
CN-111218441-B Magnetic immobilized yeast cell and application thereof in preparation of (R) -2-hydroxy-4-phenylbutyrate ethyl ester 浙江工业大学 2022-03-18 CN claimed
CN-113584096-A Preparation method and application of R-2-hydroxybenzene butyronitrile 江西科苑生物股份有限公司 2021-11-02 CN claimed
CN-105061312-A Improved preparation method of benazepril hydrochloride and pharmaceutical composition containing benazepril hydrochloride HUIZHOU XINLITAI PHARMACEUTICAL CO LTD 2015-11-18 CN claimed
US-20120041225-A1 KIT FOR AUTOMATED RESOLVING AGENT SELECTION AND METHOD THEREOF VAIDYA NITEEN A (US) 2012-02-16 US claimed
EP-1762625-B1 Reductase gene and use thereof SUMITOMO CHEMICAL CO (JP) 2009-07-15 EP claimed
EP-1981831-A2 KIT FOR AUTOMATED RESOLVING AGENT SELECTION AND METHOD THEREOF Vaidya, Niteen A. (US) 2008-10-22 EP claimed
WO-2007092264-A2 KIT FOR AUTOMATED RESOLVING AGENT SELECTION AND METHOD THEREOF VAIDYA NITEEN A (US) 2007-08-16 WO claimed
US-20070185346-A1 Kit for automated resolving agent selection and method thereof VAIDYA NITEEN A 2007-08-09 US claimed
US-6919450-B2 Process for the preparation of benazepril RANBAXY LABORATORIES LIMITED (IN) 2005-07-19 US claimed
US-20250223263-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NodThera Limited (GB) 2025-07-10 US disclosed
CN-119177259-B Method for synthesizing optically active (R) -2-hydroxy-4-phenylbutyric acid by utilizing multienzyme catalysis in micro-flow field 南京工业大学 2025-03-14 CN disclosed
US-5066826-A Treating With A Base KURARAY COMPANY, LTD. (JP) 1991-11-19 US disclosed
EP-0421472-A1 Process for racemization of optically active 4-phenylbutanoic acid esters KURARAY CO., LTD. (JP) 1991-04-10 EP disclosed
US-4525301-A REACTING TRIFLUOROMETHANE SULFONIC ACID DERIVATIVES WITH AMINO ACID ESTERS HOECHST AKTIENGESELLSCHAFT (DE) 1985-06-25 US 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 (2 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-20250223263-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NLRP3, NOD1, NLRP1 SMN1; SMN2 4362/4885MAPT 2042/4885MMP8 301/4885
US-20120041225-A1 KIT FOR AUTOMATED RESOLVING AGENT SELECTION AND METHOD THEREOF ACKR3, KIT, C3AR1 SMN1; SMN2 2706/4885MAPT 4550/4885MMP8 1824/4885

“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.