SCHEMBL8557879

SCHEMBL8557879

O=S(=O)(Nc1nc(Cc2ccccc2)oc1-c1c(F)cccc1F)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
ALDH1A1 P00352 3/20 0.44
HTR6 P50406 4/20 0.38
KDM4E B2RXH2 4/20 0.38
RXFP1 Q9HBX9 2/20 0.38
LMNA P02545 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PKM P14618 1/20 0.38
LIMK2 P53671 1/20 0.38
PGR P06401 1/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.36
G6PD P11413 1/20 0.36
NFKBIA P25963 1/20 0.36
AGTR1 P30556 1/20 0.36
METAP2 P50579 1/20 0.36
METAP1 P53582 1/20 0.36
GLO1 Q04760 1/20 0.36
PAX8 Q06710 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL8561042 0.92 MAPT (0.42) MAPTALDH1A1HTR6KDM4ELMNA
SCHEMBL8559996 0.90 CCNT1 (0.41) MAPTALDH1A1SLC40A1
SCHEMBL8556636 0.88 MAPT (0.44) MAPTALDH1A1KDM4ERXFP1LMNA
SCHEMBL8560392 0.86 MAPT (0.44) MAPTALDH1A1HTR6KDM4ERXFP1
SCHEMBL8556257 0.86 MAPT (0.46) MAPTALDH1A1HTR6KDM4ELMNA
SCHEMBL8556830 0.86 ALDH1A1 (0.42) MAPTALDH1A1HTR6KDM4ELMNA
SCHEMBL8557471 0.84 MAPT (0.48) MAPTALDH1A1KDM4ERXFP1LMNA
SCHEMBL8559708 0.84 MAPT (0.46) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8559481 0.83 ALDH1A1 (0.40) MAPTALDH1A1HTR6KDM4ELMNA
SCHEMBL8554941 0.83 MAPT (0.41) MAPTALDH1A1KDM4ERXFP1LMNA

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