SCHEMBL6480150

SCHEMBL6480150

O=c1o[nH]c(-c2ccc(F)cc2)c1-c1ccnc(CS)n1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.54
MAPK13 O15264 1/20 0.40
MAPK8 P45983 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK10 P53779 1/20 0.40
MAPK11 Q15759 1/20 0.40
TRPV3 Q8NET8 1/20 0.34
PDE10A Q9Y233 4/20 0.34
HTR2B P41595 1/20 0.33
EIF2AK2 P19525 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
TSHR P16473 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL6488935 0.91 MAPK14 (0.54) MAPK14MAPK13MAPK8MAPK12MAPK10
SCHEMBL6480144 0.79 MAPK14 (0.54) MAPK14MAPK13MAPK8MAPK12MAPK10
SCHEMBL6488266 0.79 MAPK14 (0.54) MAPK14MAPK13MAPK8MAPK12MAPK10
SCHEMBL6480652 0.71 MAPK14 (1.00) MAPK14MAPK13MAPK8MAPK12MAPK10
SCHEMBL6488932 0.69 MAPK14 (0.54) MAPK14MAPK13MAPK8MAPK12MAPK10
SCHEMBL6478990 0.69 MAPK14 (0.54) MAPK14MAPK13MAPK8MAPK12MAPK10
SCHEMBL3133617 0.69 MAPT (0.55) TRPV3MEN1NPC1RAB9AKMT2A
SCHEMBL6480260 0.57 IDO1 (0.30)
SCHEMBL1730172 0.56
SCHEMBL7582551 0.56 L3MBTL1 (0.51) MAPK14TRPV3MEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919346-B2 Isoxazolone compounds useful in treating diseases associated with unwanted cytokine activity THE PROCTER & GAMBLE COMPANY (US) 2005-07-19 US disclosed
US-6790846-B2 SUCH AS 2-ETHYOXYMETHYL-4-(4-FLOUROPHENYL)-3-PYRIDIN-4-YL-2H-ISOXAZOL-5-ONE FOR INHIBITION OF THE RELEASE OF INFLAMMATORY CYTOKINES SUCH AS INTERLEUKIN-1 AND TUMOR NECROSIS FACTOR; TREATMENT OF ARTHRITIS AND CONGESTIVE HEART FAILURE THE PROCTER & GAMBLE COMPANY 2004-09-14 US disclosed
US-20040122025-A1 Isoxazolone compounds useful in treating diseases associated with unwanted cytokine activity THE PROCTER & GAMBLE COMPANY 2004-06-24 US disclosed
US-20030096814-A1 Isoxazolone compounds useful in treating diseases associated with unwanted cytokine activity PROCTER & GAMBLE COMPANY, THE 2003-05-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030096814-A1 Isoxazolone compounds useful in treating diseases associated with unwanted cytokine activity TNF, IL5, GPR35 MAPK14 1280/4885MAPK13 2833/4885MAPK8 1808/4885
US-20040122025-A1 Isoxazolone compounds useful in treating diseases associated with unwanted cytokine activity TNF, IL5, GPR35 MAPK14 1280/4885MAPK13 2833/4885MAPK8 1808/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.