SCHEMBL824615

SCHEMBL824615

O=c1[nH]c(-c2ccccc2)cc2cc(Cl)ccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.61
KMT2A Q03164 6/20 0.61
ALDH1A1 P00352 5/20 0.61
MEN1 O00255 5/20 0.61
LMNA P02545 3/20 0.61
NPC1 O15118 2/20 0.61
MAPT P10636 2/20 0.61
RAB9A P51151 2/20 0.61
CYP19A1 P11511 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HPGD P15428 3/20 0.59
CYP2C19 P33261 3/20 0.50
CYP2C9 P11712 2/20 0.50
GAA P10253 1/20 0.50
PARP1 P09874 2/20 0.49
CYP1A2 P05177 2/20 0.49
HSD17B10 Q99714 2/20 0.49
GMNN O75496 1/20 0.49
PKM P14618 1/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL824618 0.87 KMT2A (0.59) KDM4EKMT2AALDH1A1MEN1LMNA
SCHEMBL28624953 0.82 PARP1 (0.61) KDM4EKMT2AALDH1A1MEN1LMNA
SCHEMBL30160913 0.82 PARP1 (0.61) KDM4EKMT2AALDH1A1MEN1LMNA
SCHEMBL828493 0.81 TNKS (0.63) KDM4EALDH1A1LMNANPC1MAPT
SCHEMBL29639160 0.81 TNKS (0.63) KDM4EALDH1A1LMNANPC1MAPT
SCHEMBL1536353 0.77 KDM4E (0.64) KDM4EKMT2AALDH1A1MEN1LMNA
SCHEMBL6117859 0.76 MEN1 (1.00) KDM4EKMT2AALDH1A1MEN1LMNA
SCHEMBL6646947 0.75 PARP1 (0.52) KDM4EALDH1A1LMNASMN1; SMN2PARP1
SCHEMBL9390802 0.74 LMNA (1.00) KDM4EKMT2AALDH1A1MEN1LMNA
SCHEMBL1719540 0.73 TYMS (0.49) KDM4ESMN1; SMN2PARP1TUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115521310-A Synthesis method of isoindole isoquinoline spironaphthone compound 河南师范大学 2022-12-27 CN disclosed
CN-110041257-B Method for synthesizing indene spiro indene [1,2-c ] isoquinoline triketone compound 河南师范大学 2021-08-03 CN disclosed
EP-1724262-B1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2012-05-02 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-8143274-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-03-27 US disclosed
US-8143274-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-03-27 US disclosed
US-20070185160-A1 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-08-09 US disclosed
US-20070185160-A1 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-08-09 US disclosed
US-20070185160-A1 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-08-09 US disclosed
EP-1724262-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-11-22 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-20070185160-A1 1-(2H)-isoquinolone derivative NR3C2, NR1H4, NR3C1 KDM4E 2949/4885KMT2A 3020/4885ALDH1A1 2752/4885

“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.