SCHEMBL6601327

SCHEMBL6601327

CCC(c1ccccc1)c1cc2ccccc2c(=O)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.51
KDM4E B2RXH2 4/20 0.50
GAA P10253 3/20 0.50
APAF1 O14727 4/20 0.49
CASP3 P42574 4/20 0.49
SENP8 Q96LD8 4/20 0.49
SENP7 Q9BQF6 4/20 0.49
SENP6 Q9GZR1 4/20 0.49
CASP6 P55212 3/20 0.49
CDC25B P30305 6/20 0.48
SAE1 Q9UBE0 4/20 0.48
UBA2 Q9UBT2 4/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPT P10636 3/20 0.48
THRB P10828 3/20 0.48
HPGD P15428 3/20 0.48
UBE2I P63279 2/20 0.48
RECQL P46063 2/20 0.48
GALK1 P51570 1/20 0.48
SMAD3 P84022 1/20 0.48

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
SCHEMBL20849750 0.81 LOXL2 (0.54) LOXL2KDM4EGAAAPAF1CASP3
SCHEMBL30249877 0.78 KDM4E (0.56) LOXL2KDM4EGAAAPAF1CASP3
SCHEMBL155511 0.78 KDM4E (0.56) LOXL2KDM4EGAAAPAF1CASP3
SCHEMBL155510 0.78 KDM4E (0.56) LOXL2KDM4EGAAAPAF1CASP3
SCHEMBL1721134 0.77 KDM4E (0.59) LOXL2KDM4EGAAAPAF1CASP3
SCHEMBL28890917 0.73 TNKS2 (0.56) KDM4EALDH1A1MAPTTNKS2KMT2A
SCHEMBL14948305 0.72 KDM4E (0.53) LOXL2KDM4EGAAAPAF1CASP3
SCHEMBL6602571 0.72 CYP2C9 (0.51) KDM4ECASP3SENP7ALDH1A1MAPT
SCHEMBL1720643 0.72 LOXL2 (0.68) LOXL2KDM4EGAAAPAF1CASP3
SCHEMBL23668006 0.72 CDC25B (0.54) LOXL2KDM4EGAAAPAF1CASP3

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-1397350-A1 ISOQUINOLINONE DERIVATIVES AS PARP INHIBITORS Kudos Pharmaceuticals Limited (GB) 2004-03-17 EP disclosed
US-6664269-B2 Adminisetring isoquinolinone compounds for therapy of disease mediated by the enzyme poly(ADP- ribose)polymerase (\"PARP\") MAYBRIDGE PLC (GB) 2003-12-16 US disclosed
US-20030008896-A1 Isoquinolinone derivatives KUDOS PHARMACEUTICALS LIMITED (GB) 2003-01-09 US disclosed
WO-2002090334-A1 ISOQUINOLINONE DERIVATIVES AS PARP INHIBITORS KUDOS PHARMACEUTICALS LIMITED (GB) 2002-11-14 WO 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-20030008896-A1 Isoquinolinone derivatives PARP1, PARP2, PARP3 LOXL2 3607/4885KDM4E 3073/4885GAA 423/4885

“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.