SCHEMBL5352223

SCHEMBL5352223

CCc1cc(CC)nc(S(C)(=O)=O)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
BPTF Q12830 1/20 0.35
ESR1 P03372 1/20 0.34
NPSR1 Q6W5P4 6/20 0.34
TP53 P04637 5/20 0.34
SDHB P21912 4/20 0.34
RAB9A P51151 4/20 0.34
KMT2A Q03164 4/20 0.34
HTT P42858 4/20 0.34
HSD17B10 Q99714 4/20 0.34
HPGD P15428 4/20 0.34
TLR9 Q9NR96 3/20 0.34
STAT3 P40763 3/20 0.34
MAPK1 P28482 3/20 0.34
STAT1 P42224 2/20 0.34
S1PR4 O95977 2/20 0.34
S1PR1 P21453 2/20 0.34

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
SCHEMBL16608850 0.88 LMNA (0.41) LMNASMN1; SMN2NOS3NOS2BPTF
SCHEMBL17995542 0.83 LMNA (0.38) LMNASMN1; SMN2NOS3NOS2ESR1
SCHEMBL9432383 0.83 SMN1; SMN2 (0.70) LMNASMN1; SMN2NPSR1TP53KMT2A
SCHEMBL1179309 0.82 HCAR2 (0.38) LMNASMN1; SMN2BPTFNPSR1TP53
SCHEMBL1179434 0.77 ALDH1A1 (0.47) LMNASMN1; SMN2NPSR1TP53RAB9A
SCHEMBL805467 0.75 PARP1 (0.50) LMNASMN1; SMN2NPSR1TP53KMT2A
SCHEMBL5909762 0.74 LMNA (0.32) LMNASMN1; SMN2
SCHEMBL4444099 0.71 GLP1R (0.43) LMNASMN1; SMN2NOS3NOS2NPSR1
SCHEMBL7753780 0.71 LMNA (0.52) LMNASMN1; SMN2BPTFNPSR1TP53
SCHEMBL4446017 0.69 LMNA (0.36) LMNASMN1; SMN2NOS3NOS2BPTF

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
US-7238685-B2 Benzo-fused heterocycles as endothelin antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2007-07-03 US disclosed
US-20050124605-A1 Novel benzo-fused heterocycles as endothelin antagonisits ACTELION PHARMACEUTICALS LTD. 2005-06-09 US disclosed
WO-2003013545-A1 NOVEL BENZO-FUSED HETEROCYCLES AS ENDOTHELIN ANTAGONISITS ACTELION PHARMACEUTICALS LTD (CH) 2003-02-20 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-20050124605-A1 Novel benzo-fused heterocycles as endothelin antagonisits EDNRA, EDNRB, ECE1 LMNA 983/4885SMN1; SMN2 4160/4885NOS3 493/4885

“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.