SCHEMBL8556764

SCHEMBL8556764

O=S(=O)(Nc1oc(Cc2ccccc2)nc1-c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
ALDH1A1 P00352 3/20 0.54
LIMK2 P53671 3/20 0.48
LMNA P02545 3/20 0.46
HSD11B1 P28845 2/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EDNRB P24530 4/20 0.41
EDNRA P25101 4/20 0.41
HPGD P15428 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
PTPN2 P17706 1/20 0.41

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
SCHEMBL8557761 0.92 MAPT (0.49) MAPTALDH1A1LIMK2LMNAMEN1
SCHEMBL8555221 0.92 MAPT (0.56) MAPTALDH1A1LIMK2LMNAMEN1
SCHEMBL8560530 0.92 MAPT (0.52) MAPTALDH1A1LIMK2LMNAMEN1
SCHEMBL9025133 0.90 AR (0.46) MAPTALDH1A1LIMK2LMNAPDE4A
SCHEMBL8553397 0.89 ALDH1A1 (0.49) MAPTALDH1A1LIMK2LMNAKMT2A
SCHEMBL8556526 0.89 MAPT (0.46) MAPTALDH1A1LIMK2LMNAPDE4A
SCHEMBL8555138 0.89 PGR (0.50) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL8555498 0.89 ALDH1A1 (0.49) MAPTALDH1A1LMNAPDE4APDE4B
SCHEMBL8560356 0.88 ALDH1A1 (0.51) MAPTALDH1A1LIMK2LMNANPSR1
SCHEMBL8555603 0.88 MAPT (0.48) MAPTALDH1A1LIMK2LMNAPDE4A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0699192-A1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-03-06 EP claimed
WO-1994027980-A1 SUBSTITUTED OXAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1994-12-08 WO claimed
US-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed