SCHEMBL2393687

SCHEMBL2393687

COc1cc2c(cc1O)[C@H](c1ccc(Cl)cc1)NC(=O)C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.55
CRHR2 Q13324 1/20 0.55
KMT2A Q03164 2/20 0.53
KDM1A O60341 1/20 0.43
TP53 P04637 2/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
DRD1 P21728 4/20 0.41
MAOA P21397 2/20 0.41
DRD5 P21918 2/20 0.41
CXCL12 P48061 1/20 0.41
DRD2 P14416 2/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL2387976 1.00 CRHBP (0.55) CRHBPCRHR2KMT2AKDM1ATP53
SCHEMBL10854785 0.90 CRHBP (0.67) CRHBPCRHR2KMT2ATP53TRPV1
SCHEMBL30225606 0.82 CRHBP (0.58) CRHBPCRHR2KMT2A
SCHEMBL2393838 0.82 CRHBP (0.58) CRHBPCRHR2KMT2A
SCHEMBL30225589 0.82 CRHBP (0.58) CRHBPCRHR2KMT2A
SCHEMBL23842064 0.82 CRHBP (0.58) CRHBPCRHR2KMT2A
SCHEMBL14375817 0.82 CRHBP (0.44) CRHBPCRHR2KMT2AKDM1A
SCHEMBL2391685 0.82 CRHBP (0.44) CRHBPCRHR2KMT2AKDM1A
SCHEMBL30225612 0.82 CRHBP (0.58) CRHBPCRHR2KMT2A
SCHEMBL2395864 0.82 CRHBP (0.58) CRHBPCRHR2KMT2A

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 21 patents — showing the first 20. 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-2721008-B1 HYDROXY SUBSTITUTED ISOQUINOLINONE DERIVATIVES AS P53 (MDM2 OR MDM4) INHIBITORS NOVARTIS AG (CH) 2015-04-29 EP disclosed
US-8859535-B2 Hydroxy substituted isoquinolinone derivatives NOVARTIS AG (CH) 2014-10-14 US disclosed
US-8859535-B2 Hydroxy substituted isoquinolinone derivatives NOVARTIS AG (CH) 2014-10-14 US disclosed
US-8859535-B2 Hydroxy substituted isoquinolinone derivatives NOVARTIS AG (CH) 2014-10-14 US disclosed
EP-2516009-B1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES NOVARTIS AG (CH) 2014-09-24 EP disclosed
US-20140135306-A1 HDYROXY SUBSTITUTED ISOQUINOLINONE DERIVATIVES NOVARTIS AG (CH) 2014-05-15 US disclosed
US-20140135306-A1 HDYROXY SUBSTITUTED ISOQUINOLINONE DERIVATIVES NOVARTIS AG (CH) 2014-05-15 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-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 (3 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 CRHBP 3810/4885CRHR2 3142/4885KMT2A 1137/4885
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES MDM4, MDM2, TP53 CRHBP 3810/4885CRHR2 3142/4885KMT2A 1137/4885
US-20140135306-A1 HDYROXY SUBSTITUTED ISOQUINOLINONE DERIVATIVES MDM4, MDM2, TP53 CRHBP 3581/4885CRHR2 4026/4885KMT2A 726/4885

“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.