SCHEMBL10317146

SCHEMBL10317146

CC(O)CS(=O)(=O)NCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 5/20 0.53
▸ CA2 P00918 3/20 0.53
▸ CA7 P43166 3/20 0.53
▸ CA14 Q9ULX7 3/20 0.53
▸ CA1 P00915 3/20 0.51
▸ ALDH1A1 P00352 3/20 0.49
▸ KEAP1 Q14145 1/20 0.49
▸ CA9 Q16790 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ HTT P42858 1/20 0.45
▸ OPRK1 P41145 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ RECQL P46063 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
SCHEMBL7279703 0.81 CA12 (0.47) CA12CA2CA7CA14CA1
SCHEMBL6444689 0.80 CA2 (0.50) CA12CA2CA7CA14CA1
SCHEMBL171653 0.78 CA2 (0.61) CA12CA2CA7CA14CA1
SCHEMBL6444937 0.78 CA2 (0.47) CA12CA2CA7CA14CA1
SCHEMBL6444934 0.78 CA2 (0.47) CA12CA2CA7CA14CA1
SCHEMBL2112943 0.77 CA2 (0.65) CA12CA2CA7CA14CA1
SCHEMBL13585100 0.77 CA2 (0.51) CA12CA2CA7CA14CA1
SCHEMBL13585095 0.77 CA2 (0.51) CA12CA2CA7CA14CA1
SCHEMBL21536760 0.76 CA2 (0.53) CA12CA2CA7CA14CA1
SCHEMBL7270211 0.75 CA12 (0.45) CA12CA2CA7CA14CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2620433-B1 SUBSTITUTED AMIDE COMPOUND ASTELLAS PHARMA INC (JP) 2015-05-13 — — EP disclosed
EP-2481725-B1 SUBSTITUTED AMIDE COMPOUND ASTELLAS PHARMA INC (JP) 2015-03-04 — — EP disclosed
CN-103119031-B Substituted amide compounds ASTELLAS PHARMA INC 2015-01-14 — — CN disclosed
US-8815920-B2 Substituted amide compound ASTELLAS PHARMA INC. (JP) 2014-08-26 — — US disclosed
CN-102548965-B Substituted amide compounds ASTELLAS PHARMA INC 2014-04-09 — — CN disclosed
US-8669246-B2 Substituted amide compound ASTELLAS PHARMA INC. (JP) 2014-03-11 — — US disclosed
US-20130231320-A1 SUBSTITUTED AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2013-09-05 — — US disclosed
EP-2620433-A1 SUBSTITUTED AMIDE COMPOUND Astellas Pharma Inc. (JP) 2013-07-31 — — EP disclosed
CN-103119031-A Substituted amide compounds ASTELLAS PHARMA INC 2013-05-22 — — CN disclosed
EP-2481725-A1 SUBSTITUTED AMIDE COMPOUND Astellas Pharma Inc. (JP) 2012-08-01 — — EP disclosed
US-20120184521-A1 SUBSTITUTED AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-07-19 — — US disclosed
CN-102548965-A Substituted amide compounds ASTELLAS PHARMA INC 2012-07-04 — — CN 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 (2 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-20120184521-A1 SUBSTITUTED AMIDE COMPOUND LPAR1, LPAR2, LPAR3 CA12 1544/4885CA2 685/4885CA7 1500/4885
US-20130231320-A1 SUBSTITUTED AMIDE COMPOUND LPAR1, LPAR2, LPAR3 CA12 1554/4885CA2 663/4885CA7 1434/4885

“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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