SCHEMBL3407749

SCHEMBL3407749

c1cncc(Oc2nccs2)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
CYP2A6 P11509 1/20 0.47
SYK P43405 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
TLR4 O00206 1/20 0.45
TLR2 O60603 1/20 0.45
CYP19A1 P11511 2/20 0.44
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CHRNB2 P17787 4/20 0.41
CHRNA4 P43681 4/20 0.41
LTA4H P09960 2/20 0.41
HTT P42858 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAP4K4 O95819 1/20 0.40

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
SCHEMBL2110045 0.81 TLR4 (0.49) SYKTLR4TLR2ALDH1A1SMN1; SMN2
Ethyne SCHEMBL27831513 0.78 TLR4 (0.47) SYKTLR4TLR2ALDH1A1SMN1; SMN2
SCHEMBL4685740 0.78 TLR4 (0.47) SYKTLR4TLR2SMN1; SMN2LTA4H
SCHEMBL676142 0.76 LMNA (0.82) LMNATDP1CYP2A6CYP11B1CYP11B2
SCHEMBL30535283 0.76 LMNA (0.82) LMNATDP1CYP2A6CYP11B1CYP11B2
Potassium SCHEMBL6776357 0.74 LMNA (0.78) LMNATDP1CYP2A6CYP11B1CYP11B2
SCHEMBL3577014 0.73 ALDH1A1 (0.46) CYP2A6TLR4TLR2ALDH1A1HSD17B10
SCHEMBL11578744 0.73 LMNA (0.53) LMNATDP1CYP2A6SYKCYP11B1
SCHEMBL8127212 0.72 TLR4 (0.43) TLR4TLR2SMN1; SMN2HPGD
SCHEMBL8115743 0.72 TDP1 (0.49) LMNATDP1CYP2A6SYKCYP11B1

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 LMNA 2962/4885TDP1 2645/4885CYP2A6 159/4885

“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.