SCHEMBL274802

SCHEMBL274802

O=C(O)c1nccc2cc(O)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGFBP3 P17936 1/20 0.43
KDM4E B2RXH2 4/20 0.41
ASPH Q12797 3/20 0.41
KDM8 Q8N371 3/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 2/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
AGER Q15109 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMAD3 P84022 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
CA12 O43570 2/20 0.37

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
SCHEMBL9575355 0.86 IGFBP3 (0.43) IGFBP3KDM4EASPHKDM8MEN1
SCHEMBL4726584 0.81 IGFBP3 (0.47) IGFBP3KDM4EASPHKDM8MEN1
SCHEMBL29571020 0.81 PLAU (0.50) IGFBP3KDM4EASPHKDM8MEN1
SCHEMBL755959 0.81 KDM4E (0.47) IGFBP3KDM4EASPHKDM8KMT2A
SCHEMBL754061 0.81 KMO (0.42) IGFBP3KDM4EASPHKDM8ALDH1A1
SCHEMBL24326752 0.81 PLAU (0.50) IGFBP3KDM4EASPHKDM8MEN1
SCHEMBL11374392 0.80 IGFBP3 (0.64) IGFBP3KDM4EASPHKDM8ALDH1A1
SCHEMBL13153717 0.77 KMT2A (0.42) MEN1KMT2APOLBALDH1A1TSHR
SCHEMBL16938779 0.77 NR1H4 (0.39) IGFBP3KDM4EASPHKDM8LMNA
SCHEMBL753230 0.77 LMNA (0.52) KDM4EASPHKDM8LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7304743-A None JP disclosed
US-8217045-B2 Organic compounds NOVARTIS AG (CH) 2012-07-10 US disclosed
US-20120122857-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES NOVARTIS AG (CH) 2012-05-17 US disclosed
US-8133886-B2 Heterobicyclic carboxamides as inhibitors for kinases NOVARTIS AG (CH) 2012-03-13 US disclosed
US-20110301157-A1 BICYCLIC AMIDES AS KINASE INHIBITORS NOVARTIS AG 2011-12-08 US disclosed
EP-2371822-A1 Heterobicyclic carboxamides as inhibitors for kinases Novartis AG (CH) 2011-10-05 EP disclosed
US-8026247-B2 Bicyclic amides as kinase inhibitors NOVARTIS AG (CH) 2011-09-27 US disclosed
US-20100113467-A1 Organic Compounds NOVARTIS AG 2010-05-06 US disclosed
US-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers NOVARTIS AG (CH) 2010-02-04 US disclosed
EP-1996558-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES Novartis AG (CH) 2008-12-03 EP disclosed
US-20080287427-A1 Bicyclic Amides as Kinase Inhibitors NOVARTIS AG (CH) 2008-11-20 US disclosed
WO-2007104538-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES NOVARTIS AG (CH) 2007-09-20 WO disclosed
JP-H07304743-A NEW ISOQUINOLINECARBOXYLIC ACID DERIVATIVE SNOW BRAND MILK PROD CO LTD 1995-11-21 JP 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 (5 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-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers SLC8B1, MCU, GLS IGFBP3 3466/4885KDM4E 3893/4885ASPH 3494/4885
US-20110301157-A1 BICYCLIC AMIDES AS KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K19 IGFBP3 2130/4885KDM4E 1247/4885ASPH 1473/4885
US-20100113467-A1 Organic Compounds SLCO2A1, SLCO1B1, SLCO2B1 IGFBP3 3440/4885KDM4E 3875/4885ASPH 410/4885
US-20080287427-A1 Bicyclic Amides as Kinase Inhibitors MAP3K20, MAP3K1, MAP3K19 IGFBP3 2127/4885KDM4E 1373/4885ASPH 1452/4885
US-20120122857-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES MAP3K20, PHKG1, PHKG2 IGFBP3 4270/4885KDM4E 1717/4885ASPH 2073/4885

“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.