SCHEMBL6843412

SCHEMBL6843412

Cc1cc(C)nc(NS(=O)(=O)c2ccc(N(Cc3ccc(OC(F)(F)F)cc3)Cc3ccc(OC(F)(F)F)cc3)cc2)n1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.52
FFAR4 Q5NUL3 1/20 0.51
CNR2 P34972 1/20 0.50
GAA P10253 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP3A4 P08684 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
TSHR P16473 2/20 0.48
SERPINE1 P05121 1/20 0.46
RORC P51449 1/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 1/20 0.44
GPR119 Q8TDV5 1/20 0.44

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
SCHEMBL6843093 0.85 GAA (0.52) GAAALDH1A1CYP3A4SMN1; SMN2TDP1
SCHEMBL7081820 0.83 ADRA2B (0.56) FFAR4GAAALDH1A1CYP3A4SMN1; SMN2
SCHEMBL4548140 0.80 LMNA (0.69) GAAALDH1A1MEN1POLBKMT2A
SCHEMBL18292531 0.70 GAA (0.71) FFAR4GAAALDH1A1CYP3A4SMN1; SMN2
SCHEMBL12903578 0.70 SMN1; SMN2 (0.76) GAAALDH1A1CYP3A4SMN1; SMN2TDP1
SCHEMBL7587082 0.69 FFAR4 (0.71) FFAR4SMN1; SMN2RORCTP53
SCHEMBL27228854 0.69 MEN1 (0.60) FFAR4RORCMEN1POLBKMT2A
SCHEMBL19399664 0.68 GAA (0.68) GAAALDH1A1CYP3A4SMN1; SMN2TDP1
SCHEMBL7081755 0.68 ADRA2B (0.60) GAAALDH1A1CYP3A4SMN1; SMN2TDP1
Sulfamethazine SCHEMBL151305 0.67 ALDH1A1 (1.00) GAAALDH1A1CYP3A4SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6767909-B2 CARDIOVASCULAR DISORDERS; VASOCONSTRICTION OY JUVANTIA PHARMA LTD. (FI) 2004-07-27 US disclosed
US-20030073710-A1 Compounds useful for treatment or prevention of disease mediated by alpha-2B-adrenoceptor OY JUVANTIA PHARMA LTD (FI) 2003-04-17 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-20030073710-A1 Compounds useful for treatment or prevention of disease mediated by alpha-2B-adrenoceptor ADRB2, ADRB3, ADRB1 PTGDR2 1843/4885FFAR4 939/4885CNR2 538/4885

“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.