SCHEMBL300971

SCHEMBL300971

COc1ccccc1-n1c(=O)[nH]c2c(C(N)=O)nc(Nc3ccccc3O)nc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.62
HPGD P15428 3/20 0.62
ALDH1A1 P00352 3/20 0.60
GLA P06280 2/20 0.60
GAA P10253 2/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
HSD17B10 Q99714 3/20 0.49
USP2 O75604 3/20 0.49
TSHR P16473 3/20 0.49
MAPK1 P28482 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
BRCA1 P38398 1/20 0.49
KMT2A Q03164 2/20 0.48
HDAC3 O15379 2/20 0.46
HDAC4 P56524 2/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC7 Q8WUI4 2/20 0.46
HDAC2 Q92769 2/20 0.46
HDAC10 Q969S8 2/20 0.46
HDAC11 Q96DB2 2/20 0.46

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
SCHEMBL300939 0.88 KDM4E (0.62) KDM4EHPGDALDH1A1GLAGAA
SCHEMBL301233 0.88 KDM4E (0.61) KDM4EHPGDALDH1A1GLAGAA
SCHEMBL300795 0.85 KDM4E (0.59) KDM4EHPGDALDH1A1GLAGAA
SCHEMBL27775980 0.83 CSNK2A1 (0.61) KDM4EHPGDALDH1A1GAAHSD17B10
SCHEMBL301342 0.83 KDM4E (0.65) KDM4EHPGDALDH1A1GLAGAA
SCHEMBL28298229 0.82 KDM4E (0.44) KDM4EHPGDALDH1A1GLAGAA
SCHEMBL300607 0.82 KDM4E (0.59) KDM4EHPGDALDH1A1GLAGAA
SCHEMBL300905 0.81 KDM4E (0.60) KDM4EHPGDALDH1A1GLAGAA
SCHEMBL301305 0.81 KDM4E (0.60) KDM4EHPGDALDH1A1GLAGAA
SCHEMBL15643571 0.81 KDM4E (0.60) KDM4EHPGDALDH1A1GLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2078018-B1 HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARM LLC (US) 2012-03-14 EP claimed
CN-107976546-B Inhibition of phosphorylation of TOR kinase inhibitory Activity markers PRAS40, GSK 3-beta, or P70S6K1 西格诺药品有限公司 2020-10-27 CN disclosed
CN-110721186-A Treatment of prostate cancer with TOR kinase inhibitors 西格诺药品有限公司 2020-01-24 CN disclosed
CN-107157990-B Treatment of cancer with TOR kinase inhibitors 西格诺药品有限公司 2020-01-07 CN disclosed
CN-109846884-A With TOR kinase inhibitor for treating cancer 西格诺药品有限公司 2019-06-07 CN disclosed
CN-104271138-A Treatment of cancer with tor kinase inhibitors SIGNAL PHARM LLC 2015-01-07 CN disclosed
CN-104271139-A Treatment of cancer with tor kinase inhibitors SIGNAL PHARM LLC 2015-01-07 CN disclosed
EP-2078018-A1 HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2009-07-15 EP disclosed
WO-2008051494-A1 HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2008-05-02 WO disclosed