SCHEMBL8177641

SCHEMBL8177641

O=S(=O)(Nc1ccccc1-n1cnnc1S)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCOLN3 Q8TDD5 2/20 0.44
MCOLN2 Q8IZK6 1/20 0.44
MCOLN1 Q9GZU1 1/20 0.44
ALDH1A1 P00352 2/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC40A1 Q9NP59 3/20 0.41
AGTR1 P30556 2/20 0.41
GLO1 Q04760 2/20 0.41
PAX8 Q06710 2/20 0.41
G6PD P11413 1/20 0.41
NFKBIA P25963 1/20 0.41
METAP2 P50579 1/20 0.41
METAP1 P53582 1/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PKM P14618 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 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
SCHEMBL8177640 0.78 HPGD (0.54) ALDH1A1SMN1; SMN2PKML3MBTL1MEN1
SCHEMBL8177638 0.75 HTR6 (0.51) ALDH1A1SMN1; SMN2TDP1PKML3MBTL1
SCHEMBL31681346 0.71 FFAR4 (0.45) ALDH1A1METAP2ATML3MBTL1MEN1
SCHEMBL5822509 0.70 PKM (0.57) MCOLN3MCOLN2MCOLN1ALDH1A1RECQL
SCHEMBL2067538 0.70 ALDH1A1 (0.68) ALDH1A1RECQLSMN1; SMN2SLC40A1AGTR1
SCHEMBL31070278 0.69 RECQL (0.51) MCOLN3MCOLN2MCOLN1ALDH1A1RECQL
SCHEMBL23043676 0.67 L3MBTL1 (0.79) MCOLN3MCOLN2MCOLN1ALDH1A1TDP1
SCHEMBL29978358 0.67 L3MBTL1 (0.79) MCOLN3MCOLN2MCOLN1ALDH1A1TDP1
SCHEMBL11537975 0.66 RAB9A (0.45) ALDH1A1TDP1MEN1MAPTKMT2A
SCHEMBL1151405 0.65 MAPK1 (0.41) ALDH1A1SMN1; SMN2PKML3MBTL1MEN1

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-6074813-A SILVER HALIDE PHOTOSENSITIVE MATERIAL FOR EMULSION LAYERS FUJI PHOTO FILM, CO., LTD. (JP) 2000-06-13 US disclosed