SCHEMBL8916192

SCHEMBL8916192

C=C(COC(=O)Nc1ccc(Cl)cc1)C(=O)OCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.52
GAA P10253 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
CYP19A1 P11511 1/20 0.50
NLRP3 Q96P20 1/20 0.47
MAPT P10636 4/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
HPGD P15428 1/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
MEN1 O00255 3/20 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
SCHEMBL1187952 0.83 L3MBTL1 (0.77) L3MBTL1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL8386977 0.83 ALDH1A1 (0.55) L3MBTL1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL1503906 0.77 ALDH1A1 (0.71) L3MBTL1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL11047592 0.77 L3MBTL1 (0.68) L3MBTL1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL3109040 0.76 MAPT (0.69) L3MBTL1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL6376610 0.76 L3MBTL1 (0.54) L3MBTL1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL7565510 0.75 RAB9A (0.71) L3MBTL1ALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL11960190 0.74 ALDH1A1 (0.55) L3MBTL1KMT2AALDH1A1SMN1; SMN2GAA
SCHEMBL21059175 0.74 L3MBTL1 (0.68) L3MBTL1KMT2AALDH1A1SMN1; SMN2TDP1
SCHEMBL9485165 0.74 L3MBTL1 (0.56) L3MBTL1KMT2AALDH1A1SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5637719-A PROTECTING PRIMARY OR SECONDARY AMINE RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1997-06-10 US disclosed
US-5510491-A 2-PROPENYL CHLOROFORMATE AND DERIVATIVES AS BLOCKING AGENTS FOR AMINO GROUPS OF PEPTIDES DURING PEPTIDE SYNTHESIS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1996-04-23 US disclosed
EP-0401817-B1 Reagents for rapid peptide synthesis RES CORP TECHNOLOGIES INC (US) 1995-09-13 EP disclosed
EP-0496836-B1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS RES CORP TECHNOLOGIES INC (US) 1995-06-14 EP disclosed
US-5221754-A Easily removable blocking groups to protect primary or secondary amines RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1993-06-22 US disclosed
WO-1991005564-A1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1991-05-02 WO disclosed
EP-0401817-A2 Reagents for rapid peptide synthesis RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1990-12-12 EP disclosed