SCHEMBL2390980

SCHEMBL2390980

CCOC(=O)Cc1ccc(OCc2ccc(OC)cc2)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.54
HTT P42858 3/20 0.54
NPC1 O15118 2/20 0.54
MAPT P10636 5/20 0.54
ALDH1A1 P00352 3/20 0.54
GAA P10253 1/20 0.54
GLA P06280 1/20 0.53
APP P05067 1/20 0.50
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP2D6 P10635 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
CYP1A2 P05177 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ADAMTS5 Q9UNA0 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
CALM1 P0DP23 1/20 0.47

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
SCHEMBL9724394 0.90 APP (0.62) NPC1APPCYP3A4CYP2C19SMN1; SMN2
SCHEMBL19926092 0.88 HTT (0.58) LMNAHTTNPC1MAPTALDH1A1
SCHEMBL29874847 0.88 HTT (0.58) LMNAHTTNPC1MAPTALDH1A1
SCHEMBL3782064 0.86 LMNA (0.55) LMNAMAPTALDH1A1GAACYP2C9
SCHEMBL908271 0.85 ABL1 (0.59) LMNAHTTNPC1MAPTALDH1A1
SCHEMBL9416619 0.85 APP (0.56) NPC1ALDH1A1APPCYP3A4CYP2C19
SCHEMBL14242912 0.84 FDPS (0.51) MAPTALDH1A1SMN1; SMN2L3MBTL1DRD2
SCHEMBL2392210 0.84 LMNA (0.59) LMNAHTTNPC1MAPTALDH1A1
SCHEMBL5099127 0.84 HTT (0.52) LMNAHTTNPC1MAPTALDH1A1
SCHEMBL14336130 0.83 HSD17B10 (0.55) LMNAALDH1A1GAASMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051279-B2 Substituted isoquinolinones and quinazolinones NOVARTIS AG (CH) 2015-06-09 US disclosed
US-9051279-B2 Substituted isoquinolinones and quinazolinones NOVARTIS AG (CH) 2015-06-09 US disclosed
US-9051279-B2 Substituted isoquinolinones and quinazolinones NOVARTIS AG (CH) 2015-06-09 US disclosed
EP-2516009-B1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES NOVARTIS AG (CH) 2014-09-24 EP disclosed
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES NOVARTIS AG (CH) 2013-10-24 US disclosed
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES NOVARTIS AG (CH) 2013-10-24 US disclosed
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES NOVARTIS AG (CH) 2013-10-24 US disclosed
US-8440693-B2 Substituted isoquinolinones and quinazolinones NOVARTIS AG (CH) 2013-05-14 US disclosed
US-8440693-B2 Substituted isoquinolinones and quinazolinones NOVARTIS AG (CH) 2013-05-14 US disclosed
US-8440693-B2 Substituted isoquinolinones and quinazolinones NOVARTIS AG (CH) 2013-05-14 US disclosed
EP-2516009-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES Novartis AG (CH) 2012-10-31 EP disclosed
US-20110230457-A1 Substituted Isoquinolinones and Quinazolinones NOVARTIS AG (CH) 2011-09-22 US disclosed
US-20110230457-A1 Substituted Isoquinolinones and Quinazolinones NOVARTIS AG (CH) 2011-09-22 US disclosed
US-20110230457-A1 Substituted Isoquinolinones and Quinazolinones NOVARTIS AG (CH) 2011-09-22 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-20110230457-A1 Substituted Isoquinolinones and Quinazolinones MDM4, MDM2, TP53 LMNA 1863/4885HTT 268/4885NPC1 1905/4885
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES MDM4, MDM2, TP53 LMNA 1863/4885HTT 268/4885NPC1 1905/4885

“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.