SCHEMBL15501201

SCHEMBL15501201

O=S(=O)(O)CCCCSc1nnnn1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.60
TSHR P16473 4/20 0.60
LMNA P02545 4/20 0.60
POLB P06746 3/20 0.60
HPGD P15428 3/20 0.60
NPSR1 Q6W5P4 1/20 0.60
HSD17B10 Q99714 1/20 0.59
MEN1 O00255 1/20 0.58
MAPT P10636 1/20 0.58
KMT2A Q03164 1/20 0.58
L3MBTL1 Q9Y468 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 1/20 0.54
NFKB1 P19838 1/20 0.54
RAB9A P51151 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
TP53 P04637 3/20 0.54
PKM P14618 1/20 0.53

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
SCHEMBL10970208 0.86 ALDH1A1 (0.71) ALDH1A1TSHRLMNAPOLBHPGD
SCHEMBL10973042 0.83 ALDH1A1 (0.71) ALDH1A1TSHRLMNAPOLBHPGD
SCHEMBL18797457 0.82 POLB (0.68) ALDH1A1TSHRLMNAPOLBHPGD
SCHEMBL1978183 0.81 ALDH1A1 (0.62) ALDH1A1TSHRLMNAPOLBHPGD
SCHEMBL10994113 0.80 HSD17B10 (0.70) ALDH1A1TSHRLMNAPOLBHPGD
SCHEMBL10678708 0.80 ALDH1A1 (0.70) ALDH1A1TSHRLMNAPOLBHPGD
SCHEMBL16526226 0.80 ALDH1A1 (0.70) ALDH1A1TSHRLMNAPOLBHPGD
SCHEMBL10231286 0.79 MAPT (0.53) ALDH1A1POLBHSD17B10MEN1MAPT
SCHEMBL10995696 0.79 HSD17B10 (0.62) ALDH1A1TSHRLMNAPOLBHPGD
SCHEMBL24305911 0.79 ALDH1A1 (0.68) ALDH1A1TSHRLMNAPOLBHPGD

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
EP-2163949-B1 Developer for lithographic printing plate precursor and process for producing lithographic printing plate FUJIFILM CORP (JP) 2014-03-12 EP disclosed