SCHEMBL849667

SCHEMBL849667

CCCCCc1cc2ccccc2c(=O)o1

nearest known ligand 0.97

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.97
TYMP P19971 1/20 0.55
CASP6 P55212 1/20 0.53
ALDH1A1 P00352 2/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
L3MBTL1 Q9Y468 6/20 0.52
TDP1 Q9NUW8 2/20 0.49
ATM Q13315 2/20 0.49
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.47
ALOX15 P16050 1/20 0.46

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
SCHEMBL28045491 0.98 MAPT (1.00) MAPTTYMPCASP6ALDH1A1LMNA
Dihydroartemidin SCHEMBL28045625 0.95 MAPT (0.88) MAPTTYMPCASP6ALDH1A1LMNA
SCHEMBL292962 0.84 MAPT (0.71) MAPTTYMPCASP6ALDH1A1LMNA
SCHEMBL510088 0.83 MAPT (0.74) MAPTTYMPCASP6ALDH1A1LMNA
SCHEMBL293278 0.83 MAPT (0.68) MAPTTYMPCASP6ALDH1A1LMNA
SCHEMBL10725654 0.82 MAPT (0.67) MAPTTYMPCASP6ALDH1A1LMNA
SCHEMBL28045624 0.81 MAPT (0.67) MAPTTYMPCASP6ALDH1A1LMNA
SCHEMBL511169 0.79 MAPT (0.63) MAPTTYMPCASP6ALDH1A1L3MBTL1
SCHEMBL11663319 0.78 MAPT (0.62) MAPTALDH1A1LMNASMN1; SMN2TDP1
SCHEMBL6605667 0.78 MAPT (0.61) MAPTTYMPCASP6L3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1854792-B1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2012-12-26 EP disclosed
EP-1724262-B1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2012-05-02 EP disclosed
US-8143274-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-03-27 US disclosed
US-7820693-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-10-26 US disclosed
US-20090030195-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-01-29 US disclosed
EP-1854792-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-11-14 EP disclosed
US-20070185160-A1 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-08-09 US disclosed
CN-1301951-C Method for producing deoxybenzoins BASF AG (DE) 2007-02-28 CN disclosed
EP-1724262-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-11-22 EP disclosed
CN-1602289-A Method for producing deoxybenzoin BASF AG (DE) 2005-03-30 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-20070185160-A1 1-(2H)-isoquinolone derivative NR3C2, NR1H4, NR3C1 MAPT 3539/4885TYMP 4873/4885CASP6 3871/4885
US-20090030195-A1 1-(2H)-ISOQUINOLONE DERIVATIVE NQO1, NR5A1, SRD5A1 MAPT 4671/4885TYMP 535/4885CASP6 2596/4885

“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.