SCHEMBL8917655

SCHEMBL8917655

O=C(Nc1ccc(Cl)cc1)OCC(=C(c1ccccc1)c1ccccc1)S(=O)(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
CYP19A1 P11511 2/20 0.47
LMNA P02545 1/20 0.47
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
ENPP3 O14638 1/20 0.46
ENPP1 P22413 1/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
POLB P06746 2/20 0.44
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
CYP2C9 P11712 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM4 P08173 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
SCHEMBL8916021 0.81 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL8914917 0.78 LMNA (0.42) ALDH1A1SMN1; SMN2LMNAKMT2ANPC1
SCHEMBL8914895 0.78 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL8914898 0.78 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL8914893 0.78 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL6376610 0.73 L3MBTL1 (0.54) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL9483696 0.70 MAPT (0.40) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL3795024 0.69 POLB (0.68) ALDH1A1SMN1; SMN2KMT2AMEN1CYP1A2
SCHEMBL8339054 0.67 NPSR1 (0.58) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL8914469 0.67 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2LMNAKMT2ACYP1A2

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 5 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