SCHEMBL8069327

SCHEMBL8069327

Nc1nc(-c2ccc(F)cc2)c(-c2ccc(F)cc2)s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.68
KDM4E B2RXH2 3/20 0.68
MAPK1 P28482 3/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
NPSR1 Q6W5P4 2/20 0.68
LMNA P02545 2/20 0.68
XBP1 P17861 1/20 0.68
ALDH1A1 P00352 6/20 0.67
CYP1A2 P05177 2/20 0.67
CYP2D6 P10635 2/20 0.67
CYP2C19 P33261 2/20 0.67
CYP3A4 P08684 2/20 0.64
GAA P10253 1/20 0.64
CYP2C9 P11712 1/20 0.64
TGFBR1 P36897 1/20 0.57
FBP1 P09467 1/20 0.56
MYC P01106 1/20 0.55
WDR5 P61964 1/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 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
SCHEMBL6285194 0.92 KDM4E (0.61) MAPTKDM4EMAPK1SMN1; SMN2NPSR1
Bromide SCHEMBL5698583 0.90 KDM4E (0.59) MAPTKDM4EMAPK1SMN1; SMN2NPSR1
SCHEMBL20703532 0.87 MAPT (0.58) MAPTKDM4EMAPK1SMN1; SMN2NPSR1
SCHEMBL1304933 0.85 MAPT (0.78) MAPTKDM4EMAPK1SMN1; SMN2NPSR1
SCHEMBL5205345 0.83 TGFBR1 (0.53) MAPTKDM4EMAPK1SMN1; SMN2NPSR1
SCHEMBL22048445 0.83 SMN1; SMN2 (0.52) MAPTKDM4EMAPK1SMN1; SMN2NPSR1
SCHEMBL29272745 0.82 MYC (0.57) MAPTKDM4EMAPK1SMN1; SMN2NPSR1
SCHEMBL18041639 0.82 TGFBR1 (0.65) MAPTKDM4EMAPK1SMN1; SMN2NPSR1
Propane SCHEMBL6449399 0.82 PTGS2 (0.71) PTGS2PTGS1
SCHEMBL25352230 0.81 MAPT (1.00) MAPTKDM4EMAPK1SMN1; SMN2NPSR1

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-0592664-B1 DERIVATIVES OF DIPHENYLTHIAZOLE WITH ANTIINFLAMMATORY ACTIVITY HISAMITSU PHARMACEUTICAL CO (JP) 2000-07-05 EP disclosed
US-5449783-A Antiinflammatory, analgesic, antiallergic, diuretic agents, anticoagulants HISAMITSU PHARMACEUTICAL CO., INC. (JP) 1995-09-12 US disclosed
EP-0592664-A1 NOVEL DIPHENYLTHYAZOLE DERIVATIVE Hisamitsu Pharmaceutical Co., Inc. (JP) 1994-04-20 EP disclosed