SCHEMBL393233

SCHEMBL393233

CCC#Cc1ccc(F)cc1OCc1ncccc1Br

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.34
SYK P43405 3/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
MAPK14 Q16539 4/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
FFAR1 O14842 3/20 0.32
FFAR4 Q5NUL3 2/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
GRM5 P41594 1/20 0.31

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
SCHEMBL10072773 0.87 SYK (0.36) SYKMAPK14NPC1RAB9AHTT
SCHEMBL10013572 0.87 GRM5 (0.36) PTGDR2SYKALOX5APFEN1NPC1
SCHEMBL397285 0.86 S1PR4 (0.36) PTGDR2SYKNPC1RAB9AHTT
SCHEMBL12451178 0.86 PTGDR2 (0.34) PTGDR2SYKALOX5APFEN1NPC1
SCHEMBL10042170 0.79 MAPK14 (0.41) SYKMAPK14FFAR1FFAR4
SCHEMBL10013569 0.76 NPC1 (0.37) SYKMAPK14NPC1RAB9AHTT
SCHEMBL4568541 0.72 PTGDR2 (0.35) PTGDR2NPC1RAB9ASMN1; SMN2
SCHEMBL392605 0.72 PTGDR2 (0.39) PTGDR2FFAR1FFAR4
SCHEMBL12634560 0.71 PTGDR2 (0.40) PTGDR2ALOX5APFEN1FFAR1FFAR4
SCHEMBL10013574 0.68 SGMS2 (0.34) SYKMAPK14NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101761-B2 (E)-N-{3-[1-(8-fluoro-11H-10-OXA-1-AZA-dibenzo [A,D] cyclohepten-5ylidene)-propyl]-phenyl}-methanesulfonamide as glucocorticoid receptor modulator for the treatment of rheumatoid arthritis ELI LILLY AND COMPANY (US) 2012-01-24 US disclosed
US-8101761-B2 (E)-N-{3-[1-(8-fluoro-11H-10-OXA-1-AZA-dibenzo [A,D] cyclohepten-5ylidene)-propyl]-phenyl}-methanesulfonamide as glucocorticoid receptor modulator for the treatment of rheumatoid arthritis ELI LILLY AND COMPANY (US) 2012-01-24 US disclosed
EP-2231676-B1 (E)-N-{3-[1-(8-FLUORO-11H-10-OXA-1-AZA-DIBENZO-[A,D]-CYCLOHEPTEN-5-YLIDENE)-PROPYL]-PHENYL }-METHYNSULFON AMIDE AS GLUCOCORTICOID RECEPTOR MODULATOR FOR THE TREATMENT OF RHEUMATOID ARTHRITIS LILLY CO ELI (US) 2011-08-31 EP disclosed
US-20100280062-A1 (E)-N--METHANESULFONAMIDE AS GLUCOCORTICOID RECEPTOR MODULATOR FOR THE TREATMENT OF RHEUMATOID ARTHRITIS ELI LILLY AND COMPANY (US) 2010-11-04 US disclosed
US-20100280062-A1 (E)-N--METHANESULFONAMIDE AS GLUCOCORTICOID RECEPTOR MODULATOR FOR THE TREATMENT OF RHEUMATOID ARTHRITIS ELI LILLY AND COMPANY (US) 2010-11-04 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 (1 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-20100280062-A1 (E)-N--METHANESULFONAMIDE AS GLUCOCORTICOID RECEPTOR MODULATOR FOR THE TREATMENT OF RHEUMATOID ARTHRITIS NR3C1, NR3C2, MC2R PTGDR2 153/4885SYK 543/4885ALOX5AP 842/4885

“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.