SCHEMBL5700255

SCHEMBL5700255

CC(=O)c1cc(S(C)(=O)=O)ccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
PIK3C3 Q8NEB9 2/20 0.43
LMNA P02545 1/20 0.39
ENPP2 Q13822 1/20 0.36
ROCK1 Q13464 1/20 0.36
KDM4E B2RXH2 3/20 0.36
KDM5B Q9UGL1 3/20 0.36
ALKBH5 Q6P6C2 3/20 0.36
FTO Q9C0B1 3/20 0.36
KDM5A P29375 2/20 0.36
KDM4C Q9H3R0 2/20 0.36
KDM4A O75164 2/20 0.36
KDM5C P41229 2/20 0.36
KDM6B O15054 1/20 0.36
TET3 O43151 1/20 0.36
BBOX1 O75936 1/20 0.36
MAPT P10636 1/20 0.36
ASPH Q12797 1/20 0.36
KDM4D Q6B0I6 1/20 0.36
TET2 Q6N021 1/20 0.36

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
SCHEMBL20790368 0.85 KDM4E (0.53) ALDH1A1PIK3C3LMNAENPP2KDM4E
SCHEMBL30525023 0.85 KDM4E (0.53) ALDH1A1PIK3C3LMNAENPP2KDM4E
SCHEMBL5700227 0.84 HRH4 (0.41) PIK3C3LMNAENPP2ROCK1NR1H2
SCHEMBL30874237 0.84 ADORA3 (0.40) PIK3C3LMNAROCK1KDM5BKDM5A
SCHEMBL22346451 0.82 LMNA (0.40) PIK3C3LMNAENPP2KDM5BALKBH5
SCHEMBL20791437 0.81 ALDH1A1 (0.50) ALDH1A1PIK3C3LMNAKDM4EKDM4C
SCHEMBL6742155 0.81 ALDH1A1 (0.40) ALDH1A1PIK3C3LMNAROCK1KDM4E
SCHEMBL6742993 0.78 KMT2A (0.53) ALDH1A1KDM5BALKBH5FTOKDM4A
SCHEMBL5700236 0.75 MAPT (0.45) ALDH1A1KDM4EALKBH5FTOMAPT
SCHEMBL19127799 0.74 PIK3C3 (0.64) ALDH1A1PIK3C3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1270582-B1 TRIPHENYLPHOSPHINE DERIVATIVES, PALLADIUM OR NICKEL COMPLEXES THEREOF, AND PROCESS FOR PREPARING BIARYL DERIVATIVES MITSUBISHI RAYON CO (JP) 2006-08-30 EP disclosed
US-6693210-B2 USING PALLADIUM, NICKEL PHOSPHINE COMPLEX AS CATALYSTS MITSUBISHI RAYON CO., LTD. (JP) 2004-02-17 US disclosed
US-20030065208-A1 Using palladium, nickel phosphine complex as catalysts MITSUBISHI RAYON CO., LTD. (JP) 2003-04-03 US disclosed
EP-1270582-A1 TRIPHENYLPHOSPHINE DERIVATIVE, PRODUCTION PROCESS THEREFOR, PALLADIUM COMPLEX THEREOF, AND PROCESS FOR PRODUCING BIARYL DERIVATIVE Mitsubishi Rayon Co., Ltd. (JP) 2003-01-02 EP 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-20030065208-A1 Using palladium, nickel phosphine complex as catalysts PDCD1LG2, PIK3CA, PDCD1 ALDH1A1 3993/4885PIK3C3 195/4885LMNA 4286/4885

“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.