SCHEMBL17808302

SCHEMBL17808302

Cc1cc(C(C)(C)C)ncc1S(=O)(=O)N1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ POLB P06746 2/20 0.52
▸ ALDH1A1 P00352 4/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ LMNA P02545 2/20 0.48
▸ GAA P10253 2/20 0.48
▸ TSHR P16473 5/20 0.46
▸ MCOLN3 Q8TDD5 1/20 0.46
▸ CNR1 P21554 1/20 0.45
▸ NPBWR1 P48145 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44

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
SCHEMBL17808299 0.86 ALDH1A1 (0.58) SMN1; SMN2L3MBTL1ALDH1A1KDM4EKMT2A
SCHEMBL16455682 0.83 POLB (0.56) SMN1; SMN2L3MBTL1POLBALDH1A1KDM4E
SCHEMBL23833576 0.75 KDM4E (0.55) SMN1; SMN2L3MBTL1POLBALDH1A1KDM4E
SCHEMBL22601463 0.75 LMNA (0.56) SMN1; SMN2L3MBTL1POLBALDH1A1KDM4E
SCHEMBL25364077 0.71 POLB (0.35) SMN1; SMN2L3MBTL1POLBALDH1A1TDP1
SCHEMBL2705569 0.71 SMN1; SMN2 (0.85) SMN1; SMN2L3MBTL1POLBALDH1A1MEN1
SCHEMBL15872007 0.70 ALDH1A1 (0.71) SMN1; SMN2L3MBTL1POLBALDH1A1TDP1
SCHEMBL4555634 0.70 ALDH1A1 (0.71) SMN1; SMN2L3MBTL1POLBALDH1A1TDP1
SCHEMBL13468624 0.70 SMN1; SMN2 (0.62) SMN1; SMN2L3MBTL1POLBALDH1A1MEN1
SCHEMBL14200105 0.70 ALDH1A1 (0.65) SMN1; SMN2L3MBTL1POLBALDH1A1MEN1

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-9611248-B2 Chemical compounds SYNGENTA LIMITED (GB) 2017-04-04 — — US disclosed
US-9611248-B2 Chemical compounds SYNGENTA LIMITED (GB) 2017-04-04 — — US disclosed
US-20160159767-A1 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-06-09 — — 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-20160159767-A1 CHEMICAL COMPOUNDS DDT, CBR3, CYP1B1 SMN1; SMN2 4478/4885L3MBTL1 1725/4885POLB 1307/4885

“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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