SCHEMBL6516013

SCHEMBL6516013

C=C(C(=O)c1ccc(S(N)(=O)=O)c(-c2cc(C)on2)c1)c1cc(-c2cccs2)c(OC)cc1OCC(CO)CO

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
MAPT P10636 5/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
LMNA P02545 2/20 0.31
ESR1 P03372 1/20 0.31
TSHR P16473 2/20 0.31
POLB P06746 1/20 0.30
HTT P42858 1/20 0.30
TNFRSF1A P19438 2/20 0.30
RXFP1 Q9HBX9 1/20 0.30
SCN9A Q15858 1/20 0.30

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
SCHEMBL6516020 0.86 TNFRSF1A (0.44) TNFRSF1A
SCHEMBL6040637 0.82 CA2 (0.41) CA2CA9MAPTKMT2AMEN1
SCHEMBL5559525 0.82 HPGD (0.43) CA2MAPTKMT2AMEN1TSHR
SCHEMBL6040478 0.80 CA2 (0.40) CA2CA9
SCHEMBL6040594 0.78 TNFRSF1A (0.39) MAPTKMT2AMEN1TNFRSF1ARXFP1
SCHEMBL6040746 0.75 TNFRSF1A (0.39) MAPTTNFRSF1ARXFP1
SCHEMBL5564344 0.72 NPC1 (0.45) CA2KMT2AMEN1TSHRPOLB
SCHEMBL5564202 0.71 HPGD (0.49) CA2CA9MAPTKMT2AMEN1
SCHEMBL5560084 0.71 HPGD (0.49) CA2CA9MAPTKMT2AMEN1
SCHEMBL6040578 0.69 TNFRSF1A (0.47) CA2CA9MAPTTNFRSF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050049236-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases CRABTREE ACQUISITION CO, LLC 2005-03-03 US claimed

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-20050049236-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases STS, HPSE, SULT1E1 CA2 899/4885CA9 1619/4885MAPT 2572/4885

“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.