SCHEMBL9003458

SCHEMBL9003458

C=CC(S)(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39
NPSR1 Q6W5P4 3/20 0.38
LMNA P02545 2/20 0.38
CYP2A6 P11509 1/20 0.38
MIF P14174 1/20 0.38
IDO1 P14902 2/20 0.37
BCL2 P10415 2/20 0.36
CYP19A1 P11511 4/20 0.34
HTT P42858 2/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KIF11 P52732 1/20 0.33

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
SCHEMBL9003382 0.76 TSHR (0.44) MEN1KMT2ATSHRMAPK1HIF1A
SCHEMBL2326872 0.75 TSHR (0.38) TSHRMAPK1IDO1HTTSMN1; SMN2
SCHEMBL4632476 0.71 MEN1 (0.50) MEN1KMT2ATSHRMAPK1HIF1A
SCHEMBL10767754 0.71 LMNA (0.50) MEN1KMT2ATSHRMAPK1HIF1A
SCHEMBL16312983 0.70 KIF11 (0.44) MEN1KMT2ATSHRMAPK1NPSR1
SCHEMBL8182318 0.67 MEN1 (0.56) MEN1KMT2ATSHRMAPK1HIF1A
SCHEMBL11621804 0.66 KMT2A (0.43) MEN1KMT2ATSHRMAPK1HIF1A
SCHEMBL20556751 0.64 KMT2A (0.47) MEN1KMT2ATSHRMAPK1HIF1A
SCHEMBL20556750 0.64 KMT2A (0.47) MEN1KMT2ATSHRMAPK1HIF1A
SCHEMBL28565817 0.64 LMNA (0.57) MEN1KMT2ATSHRMAPK1HIF1A

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-5500453-A INITIATOR FOR PHOTOSENSITIVE FREE RADICAL CURING/ POLYMERIZATION OF UNSATURATED COMPOUNDS TOYO INK MANUFACTURING CO., LTD. (JP) 1996-03-19 US disclosed