SCHEMBL11685641

SCHEMBL11685641

O=S(=O)(c1ccc(C(Cl)(Cl)Cl)cc1)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 2/20 0.47
PTPRZ1 P23471 1/20 0.46
KIF11 P52732 3/20 0.44
HSD11B1 P28845 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ESPL1 Q14674 1/20 0.39
EPAS1 Q99814 5/20 0.37
TSHR P16473 1/20 0.37
POLB P06746 1/20 0.37
CNR2 P34972 1/20 0.36

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
SCHEMBL5670628 0.78 LMNA (0.47) LMNAMAPK1HTTSMN1; SMN2ALDH1A1
SCHEMBL10145040 0.78 ALDH1A1 (0.69) LMNAMAPK1HTTSMN1; SMN2ALDH1A1
SCHEMBL1828426 0.77 ALDH1A1 (0.54) LMNAMAPK1HTTSMN1; SMN2ALDH1A1
SCHEMBL1156438 0.77 LMNA (0.50) LMNAMAPK1HTTSMN1; SMN2ALDH1A1
SCHEMBL3160516 0.77 ALDH1A1 (0.52) LMNAMAPK1ALDH1A1HSD11B1MEN1
SCHEMBL517720 0.75 ALDH1A1 (0.52) LMNAMAPK1HTTSMN1; SMN2ALDH1A1
SCHEMBL7937243 0.75 ALDH1A1 (0.52) LMNAMAPK1HTTSMN1; SMN2ALDH1A1
SCHEMBL11521879 0.75 ALDH1A1 (0.50) MAPK1HTTSMN1; SMN2ALDH1A1KIF11
SCHEMBL14194270 0.74 KIF11 (0.52) ALDH1A1KIF11HSD11B1CNR2
SCHEMBL6849852 0.73 CA2 (0.57) LMNAMAPK1HTTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4046656-A Photochlorination process for methyl aromatic compounds THE DOW CHEMICAL COMPANY (US) 1977-09-06 US disclosed