SCHEMBL13438728

SCHEMBL13438728

Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(C)(C)C

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.62
▸ TSHR P16473 3/20 0.62
▸ ALDH1A1 P00352 6/20 0.61
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ LMNA P02545 1/20 0.54
▸ POLB P06746 1/20 0.54
▸ KDM4E B2RXH2 2/20 0.52
▸ HSD17B10 Q99714 2/20 0.52
▸ CASP1 P29466 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ MAPT P10636 1/20 0.52

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
SCHEMBL12757098 0.83 SMN1; SMN2 (0.75) SMN1; SMN2TSHRALDH1A1MEN1KMT2A
SCHEMBL29955875 0.79 TSHR (0.65) SMN1; SMN2TSHRALDH1A1MEN1KMT2A
SCHEMBL25159990 0.79 TSHR (0.78) SMN1; SMN2TSHRALDH1A1MEN1KMT2A
SCHEMBL3409012 0.79 TSHR (0.65) SMN1; SMN2TSHRALDH1A1MEN1KMT2A
SCHEMBL29483541 0.79 TSHR (0.68) SMN1; SMN2TSHRALDH1A1MEN1KMT2A
SCHEMBL13462508 0.78 SMN1; SMN2 (0.63) SMN1; SMN2TSHRALDH1A1MEN1KMT2A
SCHEMBL1459692 0.78 SMN1; SMN2 (0.71) SMN1; SMN2TSHRALDH1A1MEN1KMT2A
SCHEMBL12169381 0.77 LMNA (0.71) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL16480610 0.77 ALDH1A1 (0.73) SMN1; SMN2TSHRALDH1A1LMNAPOLB
SCHEMBL711636 0.77 ABL1 (0.71) SMN1; SMN2TSHRALDH1A1MEN1KMT2A

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-20100056505-A1 Substituted Pyrazalones BIOGEN IDEC MA INC. 2010-03-04 — — 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-20100056505-A1 Substituted Pyrazalones ACVR1, ACVRL1, TGFBR1 SMN1; SMN2 4777/4885TSHR 1477/4885ALDH1A1 507/4885

“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.

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