SCHEMBL6352959

SCHEMBL6352959

CC1CCCN1S(=O)(=O)c1cccc(C(=O)O)c1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 7/20 0.61
▸ MAPT P10636 1/20 0.60
▸ IL1RN P18510 1/20 0.60
▸ KMT2A Q03164 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ APEX1 P27695 1/20 0.52
▸ LMNA P02545 2/20 0.52
▸ ALDH1A1 P00352 3/20 0.51
▸ AKR1C1 Q04828 3/20 0.51
▸ EPHX2 P34913 1/20 0.51

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
SCHEMBL11727554 0.83 AKR1C3 (0.67) AKR1C3MAPTIL1RNKMT2AMEN1
SCHEMBL13780083 0.81 PSEN1 (0.65) AKR1C3KMT2ALMNA
SCHEMBL6810343 0.81 PSEN1 (0.65) AKR1C3KMT2ALMNA
SCHEMBL12203854 0.81 PSEN1 (0.65) AKR1C3KMT2ALMNA
SCHEMBL28092047 0.81 AKR1C3 (0.58) AKR1C3MAPTIL1RNKMT2AMEN1
SCHEMBL6351883 0.81 AKR1C3 (0.60) AKR1C3MAPTIL1RNKMT2AMEN1
SCHEMBL16169927 0.80 PSEN1 (0.52) AKR1C3KMT2ALMNAALDH1A1
SCHEMBL22501560 0.80 LMNA (0.74) AKR1C3MAPTKMT2AMEN1LMNA
SCHEMBL14696960 0.78 ALDH1A1 (0.78) AKR1C3MAPTIL1RNKMT2AMEN1
SCHEMBL28004341 0.78 MAPT (0.57) AKR1C3MAPTKMT2AMEN1LMNA

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-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 — — 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-20050113450-A1 Antibacterial agents CLPP, SPOUT1, SAMHD1 AKR1C3 3288/4885MAPT 4753/4885IL1RN 2514/4885

“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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