SCHEMBL8914469

SCHEMBL8914469

O=S(=O)(C(CO)=C(c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
S1PR2 O95136 1/20 0.41
LMNA P02545 1/20 0.41
PRNP P04156 1/20 0.41
XBP1 P17861 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
HSD11B1 P28845 2/20 0.41
PTGS2 P35354 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40

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
SCHEMBL8916022 0.78 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TP53MAPTKMT2A
SCHEMBL8914917 0.75 LMNA (0.42) ALDH1A1SMN1; SMN2TP53MAPTKMT2A
SCHEMBL9483696 0.75 MAPT (0.40) ALDH1A1SMN1; SMN2MAPTKMT2ALMNA
SCHEMBL5187614 0.73 HSD11B1 (0.52) ALDH1A1SMN1; SMN2TP53MAPTKMT2A
SCHEMBL9266719 0.72 TSHR (0.43) ALDH1A1SMN1; SMN2TP53MAPTKMT2A
SCHEMBL6627278 0.69 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TP53MAPTKMT2A
Glycolic Acid SCHEMBL28147217 0.68 NR4A2 (0.56) ALDH1A1SMN1; SMN2MAPTKMT2ALMNA
SCHEMBL4909527 0.67 TSHR (0.46) ALDH1A1SMN1; SMN2TP53MAPTKMT2A
SCHEMBL27456891 0.67 PSIP1 (0.48) ALDH1A1SMN1; SMN2TP53MAPTKMT2A
Sulfuric Acid SCHEMBL27746204 0.67 TSHR (0.50) ALDH1A1SMN1; SMN2MAPTKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0401817-B1 Reagents for rapid peptide synthesis RES CORP TECHNOLOGIES INC (US) 1995-09-13 EP claimed
EP-0401817-A2 Reagents for rapid peptide synthesis RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1990-12-12 EP claimed
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
EP-0496836-A4 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS 1993-05-05 EP disclosed
EP-0496836-A1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS. RES CORP TECHNOLOGIES INC (US) 1992-08-05 EP 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