SCHEMBL4729340

SCHEMBL4729340

C=CC[C@@]1(C(=O)O)O[C@H]1c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
ALDH1A1 P00352 4/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 2/20 0.33
CYP2C19 P33261 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
HTT P42858 1/20 0.32
CACNA1D Q01668 1/20 0.32
AKT1 P31749 1/20 0.32
SLC6A4 P31645 1/20 0.32
PTGS2 P35354 1/20 0.31
MAPT P10636 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MITF O75030 1/20 0.31
RAB9A P51151 1/20 0.31
UBE2I P63279 1/20 0.31
SAE1 Q9UBE0 1/20 0.31

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
SCHEMBL4730030 1.00 LMNA (0.35) LMNAALDH1A1KMT2AMEN1POLB
SCHEMBL4729335 1.00 LMNA (0.35) LMNAALDH1A1KMT2AMEN1POLB
SCHEMBL4884144 0.78 TSHR (0.39) ALDH1A1KMT2AMEN1POLBTSHR
SCHEMBL8876521 0.78 TSHR (0.39) ALDH1A1KMT2AMEN1POLBTSHR
SCHEMBL273608 0.78 TSHR (0.39) ALDH1A1KMT2AMEN1POLBTSHR
SCHEMBL27658256 0.73 ALDH1A1 (0.33) LMNAALDH1A1KMT2AMEN1POLB
SCHEMBL13059640 0.72 POLB (0.37) KMT2AMEN1POLBTSHRMAPT
SCHEMBL16467542 0.70
SCHEMBL15659315 0.69 TSHR (0.37) ALDH1A1KMT2AMEN1POLBTSHR
SCHEMBL4888244 0.69 KDM1A (0.38) ALDH1A1KMT2APOLBTSHRSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1601778-B1 STEREOSELECTIVE CHEMOENZYMATIC PROCESS FOR PREPARING OPTICALLY ENRICHED PHENYLGLYCIDATES COUNCIL SCIENT IND RES (IN) 2008-07-02 EP claimed
US-7060471-B2 Stereoselective chemoenzymatic process for the preparation of optically enriched phenylglycidates as precursors of taxol side chain COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2006-06-13 US claimed
US-20040259943-A1 Stereoselective chemoenzymatic process for the preparation of optically enriched phenylglycidates as precursors of taxol side chain COUNCIL OF SCIENTIFIC AND INDUSTRIAL (IN) 2004-12-23 US claimed
CN-100400669-C Stereoselective chemoenzymatic process for preparing optically enriched phenylglycidates COUNCIL SCIENT IND RES (IN) 2008-07-09 CN disclosed
EP-1601778-B1 STEREOSELECTIVE CHEMOENZYMATIC PROCESS FOR PREPARING OPTICALLY ENRICHED PHENYLGLYCIDATES COUNCIL SCIENT IND RES (IN) 2008-07-02 EP disclosed
EP-1601778-B1 STEREOSELECTIVE CHEMOENZYMATIC PROCESS FOR PREPARING OPTICALLY ENRICHED PHENYLGLYCIDATES COUNCIL SCIENT IND RES (IN) 2008-07-02 EP disclosed
US-7060471-B2 Stereoselective chemoenzymatic process for the preparation of optically enriched phenylglycidates as precursors of taxol side chain COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2006-06-13 US disclosed
US-7060471-B2 Stereoselective chemoenzymatic process for the preparation of optically enriched phenylglycidates as precursors of taxol side chain COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2006-06-13 US disclosed
CN-1759185-A Stereoselective chemoenzymatic process for preparing optically enriched phenylglycidates COUNCIL SCIENT IND RES (IN) 2006-04-12 CN disclosed
EP-1601778-A1 STEREOSELECTIVE CHEMOENZYMATIC PROCESS FOR PREPARING OPTICALLY ENRICHED PHENYLGLYCIDATES Council of Scientific and Industrial Research (IN) 2005-12-07 EP disclosed
US-20040259943-A1 Stereoselective chemoenzymatic process for the preparation of optically enriched phenylglycidates as precursors of taxol side chain COUNCIL OF SCIENTIFIC AND INDUSTRIAL (IN) 2004-12-23 US disclosed
US-20040259943-A1 Stereoselective chemoenzymatic process for the preparation of optically enriched phenylglycidates as precursors of taxol side chain COUNCIL OF SCIENTIFIC AND INDUSTRIAL (IN) 2004-12-23 US disclosed
WO-2004081219-A1 STEREOSELECTIVE CHEMOENZYMATIC PROCESS FOR PREPARING OPTICALLY ENRICHED PHENYLGLYCIDATES COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-09-23 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-20040259943-A1 Stereoselective chemoenzymatic process for the preparation of optically enriched phenylglycidates as precursors of taxol side chain GMDS, GPI, B3GAT3 LMNA 2836/4885ALDH1A1 438/4885KMT2A 3273/4885

“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.