SCHEMBL8556399

SCHEMBL8556399

O=S(=O)(Nc1oc(Cc2ccccc2)nc1-c1ccc(Cl)cc1Cl)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
LMNA P02545 3/20 0.49
ALDH1A1 P00352 2/20 0.49
FBP1 P09467 3/20 0.45
PGR P06401 1/20 0.44
HSD11B1 P28845 1/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
NPC1 O15118 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC40A1 Q9NP59 1/20 0.40
CYP3A4 P08684 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
CNR1 P21554 2/20 0.39
POLB P06746 1/20 0.39
ERBB2 P04626 1/20 0.39

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
SCHEMBL8559381 0.92 ALDH1A1 (0.49) MAPTLMNAALDH1A1FBP1PGR
SCHEMBL8555963 0.90 ALDH1A1 (0.47) MAPTLMNAALDH1A1PGRSLC40A1
SCHEMBL8553419 0.90 ALDH1A1 (0.50) MAPTLMNAALDH1A1FBP1PGR
SCHEMBL8557399 0.89 MAPT (0.49) MAPTLMNAALDH1A1FBP1PGR
SCHEMBL8560880 0.87 MAPT (0.48) MAPTLMNAALDH1A1FBP1PGR
SCHEMBL8554218 0.87 ALDH1A1 (0.44) MAPTLMNAALDH1A1PGRNPC1
SCHEMBL8555221 0.84 MAPT (0.56) MAPTLMNAALDH1A1FBP1PGR
SCHEMBL8555138 0.84 PGR (0.50) MAPTLMNAALDH1A1FBP1PGR
SCHEMBL8557926 0.84 LMNA (0.49) MAPTLMNAALDH1A1FBP1PGR
SCHEMBL8560073 0.83 ALDH1A1 (0.50) MAPTLMNAALDH1A1FBP1PGR

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-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed