SCHEMBL19002162

SCHEMBL19002162

CSCc1ccc(C2(c3ccc(CSC)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
OPRK1 P41145 1/20 0.53
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
POLB P06746 1/20 0.38
PDK2 Q15119 5/20 0.34
KIF11 P52732 1/20 0.32
MDM2 Q00987 3/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
S100A4 P26447 1/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL23310456 0.83 ESR1 (0.44) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL8984806 0.81 MAPT (0.57) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL20414401 0.78 SMN1; SMN2 (0.53) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL5492754 0.77 MEN1 (0.57) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL4258846 0.77 MEN1 (0.57) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL14353392 0.77 MEN1 (0.57) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL15283118 0.77 MEN1 (0.62) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL19002147 0.76 MEN1 (0.52) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL14122566 0.75 MEN1 (0.71) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL30516188 0.75 MEN1 (0.71) MAPTMEN1KMT2ASMN1; SMN2KDM4E

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-20170175078-A1 CELL CULTURE SUBSTRATE COMPRISING FLUORINE-CONTAINING POLYMER ON ITS SURFACE NIPPON SHOKUBAI, CO., LTD. (JP) 2017-06-22 US disclosed