SCHEMBL15501170

SCHEMBL15501170

O=S(=O)(O)CCCSc1nc2ccccc2[nH]1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.67
BCHE P06276 1/20 0.67
NPC1 O15118 3/20 0.65
RAB9A P51151 2/20 0.65
EPHX2 P34913 1/20 0.64
AR P10275 3/20 0.62
ALDH1A1 P00352 2/20 0.60
MAPT P10636 5/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
KDM4E B2RXH2 1/20 0.58
KMT2A Q03164 3/20 0.57
POLB P06746 1/20 0.56
GAA P10253 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
HTT P42858 1/20 0.54
TP53 P04637 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
SCHEMBL28623296 0.87 BCHE (0.65) LMNABCHENPC1RAB9AEPHX2
SCHEMBL14304932 0.85 BCHE (0.86) LMNABCHENPC1RAB9AEPHX2
SCHEMBL14303261 0.83 BCHE (0.83) LMNABCHENPC1RAB9AEPHX2
SCHEMBL14303260 0.83 BCHE (0.83) LMNABCHENPC1RAB9AEPHX2
SCHEMBL14304387 0.83 BCHE (0.83) LMNABCHENPC1RAB9AEPHX2
SCHEMBL6141660 0.83 BCHE (0.83) LMNABCHENPC1RAB9AEPHX2
SCHEMBL14304381 0.83 BCHE (0.83) LMNABCHENPC1RAB9AEPHX2
SCHEMBL6603238 0.82 EPHX2 (0.82) LMNABCHENPC1RAB9AEPHX2
Bromide SCHEMBL5084026 0.82 BCHE (0.80) LMNABCHENPC1RAB9AEPHX2
SCHEMBL11475158 0.81 BCHE (1.00) LMNABCHENPC1RAB9AEPHX2

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