SCHEMBL2392671

SCHEMBL2392671

COc1cc(CC(=O)Cl)ccc1OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.60
RAB9A P51151 3/20 0.60
HPGD P15428 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
MTNR1A P48039 2/20 0.59
MTNR1B P49286 2/20 0.59
APP P05067 1/20 0.59
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
PKM P14618 1/20 0.58
MRGPRX4 Q96LA9 1/20 0.56
RXRA P19793 1/20 0.56
PTGER4 P35408 1/20 0.56
PTGER2 P43116 1/20 0.56
ATM Q13315 1/20 0.55
CTSV O60911 1/20 0.54
CTSL P07711 1/20 0.54
BCHE P06276 1/20 0.54
KDM4E B2RXH2 1/20 0.53
CYP1A2 P05177 1/20 0.53

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
SCHEMBL2394315 0.94 SMPD1 (0.59) NPC1RAB9AHPGDSMN1; SMN2MTNR1A
SCHEMBL8072945 0.91 PTGER1 (0.52) NPC1RAB9AHPGDSMN1; SMN2MTNR1A
SCHEMBL2394307 0.89 NPC1 (0.58) NPC1RAB9AHPGDSMN1; SMN2MTNR1A
SCHEMBL1114985 0.89 NPC1 (0.63) NPC1RAB9AHPGDSMN1; SMN2MTNR1A
SCHEMBL31011346 0.89 NPC1 (0.63) NPC1RAB9AHPGDSMN1; SMN2MTNR1A
SCHEMBL10731769 0.87 MTNR1A (0.64) NPC1RAB9AHPGDSMN1; SMN2MTNR1A
SCHEMBL29066085 0.86 MTNR1A (0.62) NPC1RAB9AHPGDSMN1; SMN2MTNR1A
SCHEMBL6366353 0.85 NPC1 (0.59) NPC1RAB9AHPGDSMN1; SMN2MTNR1A
SCHEMBL76377 0.83 LMNA (0.59) NPC1HPGDSMN1; SMN2KMT2AMEN1
SCHEMBL2391945 0.83 SMPD1 (0.61) NPC1RAB9AHPGDSMN1; SMN2MTNR1A

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 16 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
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
US-5158948-A Treating neurological and psychological disorders ABBOTT LABORATORIES (US) 1992-10-27 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 NPC1 1905/4885RAB9A 2504/4885HPGD 1735/4885
US-20130281473-A1 SUBSTITUTED ISOQUINOLINONES AND QUINAZOLINONES MDM4, MDM2, TP53 NPC1 1905/4885RAB9A 2504/4885HPGD 1735/4885

“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.