SCHEMBL301187

SCHEMBL301187

COc1ccccc1-n1cnc2c(C(N)=O)nc(Nc3cccc(O)c3)nc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.41
CDK2 P24941 2/20 0.41
PLK1 P53350 2/20 0.41
CHEK1 O14757 1/20 0.41
PAK4 O96013 1/20 0.41
CSNK2A2 P19784 1/20 0.41
MAPK1 P28482 1/20 0.41
AKT1 P31749 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
MAP2K1 Q02750 1/20 0.41
SCN9A Q15858 1/20 0.40
ADRA2B P18089 2/20 0.40
WEE1 P30291 1/20 0.39
MAPK9 P45984 1/20 0.39
SLC2A1 P11166 1/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
LRRK2 Q5S007 1/20 0.38

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
SCHEMBL27775430 0.84 XDH (0.50) MAPK8CDK2PLK1CHEK1PAK4
SCHEMBL28142469 0.83 SYK (0.39) CDK2ADRA2BWEE1STK10GSK3B
SCHEMBL300845 0.82 THRB (0.49) MAPK1LMNATP53TSHRTHRB
SCHEMBL300795 0.79 KDM4E (0.59) CSNK2A2MAPK1CSNK2BCSNK2A1LMNA
SCHEMBL4239392 0.78 SLC2A1 (0.34) MAPK8CDK2PLK1CHEK1PAK4
SCHEMBL300887 0.75 LMNA (0.51) MAPK1SCN9ALMNATP53TSHR
SCHEMBL1748994 0.75 HSD17B10 (0.48) MAPK8CDK2PLK1CHEK1PAK4
SCHEMBL15206286 0.69 GSK3B (0.48) PLK1MAPK1WEE1LMNATSHR
SCHEMBL301233 0.68 KDM4E (0.61) CSNK2A2MAPK1CSNK2BCSNK2A1LMNA
SCHEMBL28142358 0.68 CHKA (0.39) ADRA2BLMNATP53TSHRABCB1

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 19 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-108992446-A With TOR kinase inhibitor for treating cancer 西格诺药品有限公司 2018-12-14 CN disclosed
CN-104271159-B The method that non-small cell lung cancer is treated using the therapeutic alliance of TOR kinase inhibitors 西格诺药品有限公司 2017-11-28 CN disclosed
CN-107157990-A Utilize TOR kinase inhibitor for treating cancers 西格诺药品有限公司 2017-09-15 CN disclosed
CN-107137402-A With TOR kinase inhibitor for treating cancers 西格诺药品有限公司 2017-09-08 CN disclosed
CN-104302295-B Treatment of cancer with TOR kinase inhibitors 西格诺药品有限公司 2017-06-20 CN disclosed
CN-103998036-B Treatment of cancer with TOR kinase inhibitors 西格诺药品有限公司 2017-05-31 CN disclosed
CN-105050601-A Treatment of prostate cancer with TOR kinase inhibitors SIGNAL PHARM LLC 2015-11-11 CN disclosed
CN-104519885-A Treatment of cancer with TOR kinase inhibitors SIGNAL PHARM LLC 2015-04-15 CN disclosed
CN-104302295-A Treatment of cancer with tor kinase inhibitors SIGNAL PHARM LLC 2015-01-21 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
CN-104271159-A Methods for treating non- small cell lung cancer using tor kinase inhibitor combination therapy 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