SCHEMBL2390600

SCHEMBL2390600

CNC(=O)CN[C@H]1CC[C@H](CN(C)c2ccc(I)cn2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 1/20 0.39
MDM2 Q00987 1/20 0.39
CACNA1H O95180 1/20 0.38
DYRK1A Q13627 4/20 0.34
MELK Q14680 13/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
USP30 Q70CQ3 1/20 0.32
BMPR1B O00238 1/20 0.31
PLK4 O00444 1/20 0.31
CIT O14578 1/20 0.31
AURKA O14965 1/20 0.31
GAK O14976 1/20 0.31
EPHB6 O15197 1/20 0.31
RIPK2 O43353 1/20 0.31
ERN1 O75460 1/20 0.31
RPS6KA5 O75582 1/20 0.31
RPS6KA4 O75676 1/20 0.31
STK16 O75716 1/20 0.31
STK10 O94804 1/20 0.31

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
SCHEMBL2390604 1.00 MDM4 (0.39) MDM4MDM2CACNA1HDYRK1AMELK
SCHEMBL2392514 0.87 CACNA1H (0.36) MDM4MDM2CACNA1HMELKUSP30
SCHEMBL2392518 0.87 CACNA1H (0.36) MDM4MDM2CACNA1HMELKUSP30
SCHEMBL2393464 0.83 MDM2 (0.41) MDM4MDM2MEN1KMT2A
SCHEMBL2393466 0.83 MDM2 (0.41) MDM4MDM2MEN1KMT2A
SCHEMBL2395506 0.81 MDM4 (0.37) MDM4MDM2CACNA1HDYRK1AMELK
SCHEMBL2395504 0.81 MDM4 (0.37) MDM4MDM2CACNA1HDYRK1AMELK
SCHEMBL12258924 0.80 CACNA1H (0.32) MDM4MDM2CACNA1HMELK
SCHEMBL12258803 0.80 CACNA1H (0.35) CACNA1H
SCHEMBL2391108 0.79 MDM4 (0.36) MDM4MDM2CACNA1HDYRK1AMELK

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 MDM4 1/4885MDM2 2/4885CACNA1H 4401/4885
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES MDM4, MDM2, TP53 MDM4 1/4885MDM2 2/4885CACNA1H 4401/4885

“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.