SCHEMBL7187556

SCHEMBL7187556

O=C(O)c1ccc(S(=O)(=O)Oc2cccc3ccccc23)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.47
FABP4 P15090 2/20 0.44
WDR5 P61964 1/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
DAPK1 P53355 1/20 0.43
PIM3 Q86V86 1/20 0.43
TSHR P16473 2/20 0.42
SCN9A Q15858 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
HPGD P15428 2/20 0.40
ESR1 P03372 1/20 0.40
GAA P10253 1/20 0.40
ESR2 Q92731 1/20 0.40
NPC1 O15118 1/20 0.40
MITF O75030 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
SCHEMBL7189988 0.79 KMT2A (0.49) MRGPRX4KMT2AMEN1DAPK1PIM3
SCHEMBL7197754 0.75 MEN1 (0.47) MRGPRX4KMT2AMEN1SCN9AALDH1A1
SCHEMBL11702500 0.74 NR4A1 (0.51) WDR5KMT2AMEN1ALDH1A1KDM4E
SCHEMBL6099899 0.73 HTR6 (0.54) KMT2AMEN1ALDH1A1KDM4EHSD17B10
SCHEMBL11577305 0.72 HTR6 (0.53) KMT2AMEN1ALDH1A1KDM4EHSD17B10
SCHEMBL10881406 0.72 KMT2A (0.59) KMT2AMEN1ALDH1A1KDM4EHSD17B10
SCHEMBL15758201 0.70 NR4A1 (0.57) FABP4WDR5KMT2AMEN1TSHR
Formaldehyde SCHEMBL29278572 0.70 HTR6 (0.52) KMT2AMEN1ALDH1A1KDM4EHSD17B10
SCHEMBL7207925 0.70 KMT2A (0.45) KMT2AMEN1SCN9AALDH1A1KDM4E
SCHEMBL7195634 0.70 NR4A1 (0.49) MRGPRX4KMT2AMEN1DAPK1PIM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1304924-A2 COMPOSITIONS FOR REPELLING CRAWLING INSECTS Bayer Aktiengesellschaft (DE) 2003-05-02 EP disclosed
WO-2002005646-A2 COMPOSITIONS FOR REPELLING CRAWLING INSECTS S.C. JOHNSON & SON, INC. (US) (US) 2002-01-24 WO disclosed