SCHEMBL6372017

SCHEMBL6372017

CCc1cc(-c2ccc(S(=O)(=O)N3CCN(CCN4CCCC4)CC3)s2)c(C)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ KMT2A Q03164 3/20 0.41
▸ ALDH1A1 P00352 5/20 0.36
▸ LMNA P02545 3/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ CDC7 O00311 1/20 0.35
▸ ROCK1 Q13464 1/20 0.35
▸ DBF4 Q9UBU7 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ RECQL P46063 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MEN1 O00255 1/20 0.34

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
Hydrochloric Acid SCHEMBL2673197 0.99 KDM4E (0.42) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL6371055 0.99 KDM4E (0.42) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL6371076 0.96 KDM4E (0.42) MAPTKDM4EKMT2AALDH1A1LMNA
Hydrochloric Acid SCHEMBL2674562 0.95 KDM4E (0.41) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL6372581 0.91 ALDH1A1 (0.42) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL11917233 0.91 KMT2A (0.40) MAPTKDM4EKMT2ALMNAHTT
Hydrochloric Acid SCHEMBL2674685 0.90 ALDH1A1 (0.42) MAPTKDM4EKMT2AALDH1A1LMNA
SCHEMBL2673669 0.90 KMT2A (0.51) MAPTKDM4EKMT2AALDH1A1L3MBTL1
SCHEMBL6371080 0.89 MAPT (0.39) MAPTKDM4EKMT2ALMNAHTT
Hydrochloric Acid SCHEMBL2679881 0.89 MAPT (0.39) MAPTKDM4EKMT2ALMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732896-B1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) AVENTIS PHARMA INC (US) 2012-12-12 — — EP claimed
EP-1732896-B1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) AVENTIS PHARMA INC (US) 2012-12-12 — — EP disclosed
US-20120202795-A1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) AVENTIS PHARMACEUTICALS INC. (US) 2012-08-09 — — US disclosed
US-20120202795-A1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) AVENTIS PHARMACEUTICALS INC. (US) 2012-08-09 — — US disclosed
US-8173682-B2 Substituted pyridones as inhibitors of poly(ADP-ribose) polymerase (PARP) AVENTIS PHARMACEUTICALS INC. (US) 2012-05-08 — — US disclosed
US-8173682-B2 Substituted pyridones as inhibitors of poly(ADP-ribose) polymerase (PARP) AVENTIS PHARMACEUTICALS INC. (US) 2012-05-08 — — US disclosed
US-20070032489-A1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) AVENTIS PHARMACEUTICALS INC. (US) 2007-02-08 — — US disclosed
US-20070032489-A1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) AVENTIS PHARMACEUTICALS INC. (US) 2007-02-08 — — 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 (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-20120202795-A1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) PARP1, PARP2, PARP3 MAPT 2438/4885KDM4E 1262/4885KMT2A 1291/4885
US-20070032489-A1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) PARP1, PARP2, PARP3 MAPT 2438/4885KDM4E 1262/4885KMT2A 1291/4885

“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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