SCHEMBL3408023

SCHEMBL3408023

Cn1nc(Oc2nccs2)cc1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.48
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.39
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SCN9A Q15858 5/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRM5 P08912 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL3410199 0.92 PKM (0.45) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL3382600 0.71 PKM (0.57) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL3414853 0.70 PKM (0.44) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL3413010 0.70 PKM (0.41) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL3408610 0.70 PKM (0.47) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL3408665 0.70 PKM (0.44) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL8111889 0.70 PKM (0.55) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL6529529 0.68 PKM (0.47) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL14168715 0.67 PKM (0.53) PKMNPC1RAB9AMAPTSMN1; SMN2
SCHEMBL9474164 0.66 PKM (0.45) PKMNPC1RAB9AMAPTSMN1; SMN2

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-2262794-A1 SULFONAMIDE COMPOUNDS AND THEIR USE AS FUNGICIDE BASF SE (DE) 2010-12-22 EP disclosed
US-20100317516-A1 Sulfonamide Compounds And Their Use As Fungicide BASF SE (DE) 2010-12-16 US disclosed
WO-2009103650-A1 SULFONAMIDE COMPOUNDS AND THEIR USE AS FUNGICIDE BASF SE (DE) 2009-08-27 WO 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-20100317516-A1 Sulfonamide Compounds And Their Use As Fungicide STS, ARSA, CYP4X1 PKM 2018/4885NPC1 3943/4885RAB9A 1749/4885

“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.