SCHEMBL1138486

SCHEMBL1138486

COc1nc2ccc(F)cc2nc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 2/20 0.43
BACE1 P56817 1/20 0.41
PI4KA P42356 2/20 0.39
PIK3CG P48736 2/20 0.39
MAPK14 Q16539 1/20 0.39
AXL P30530 1/20 0.39
GFER P55789 1/20 0.39
TLR8 Q9NR97 1/20 0.38
NQO2 P16083 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
RAD52 P43351 1/20 0.36

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
SCHEMBL4931938 1.00 KDM4E (0.44) KDM4EKMT2ABACE1PI4KAPIK3CG
SCHEMBL1712420 0.87 KDM4E (0.52) KDM4EKMT2ABACE1MAPK14NQO2
SCHEMBL4916971 0.82 NQO1 (0.41) KDM4EKMT2ATLR8NQO2MEN1
SCHEMBL11725621 0.81 KDM4E (0.57) KDM4EKMT2ABACE1AXLGFER
SCHEMBL1138250 0.81 MEN1 (0.59) KDM4EKMT2AMAPK14NQO2MEN1
SCHEMBL1138314 0.81 NQO2 (0.50) KDM4EKMT2ABACE1TLR8NQO2
SCHEMBL4920558 0.81 NQO2 (0.50) KDM4EKMT2ABACE1TLR8NQO2
SCHEMBL4930422 0.81 MEN1 (0.59) KDM4EKMT2AMAPK14NQO2MEN1
SCHEMBL15870617 0.81 KDM4E (0.46) KDM4EKMT2AMAPK14NQO2MEN1
SCHEMBL804778 0.81 KDM4E (0.46) KDM4EKMT2AMAPK14NQO2MEN1

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200231553-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE REXAHN PHARMACEUTICALS, INC. (US) 2020-07-23 US claimed
US-20180290985-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE REXAHN PHARMACEUTICALS, INC. (US) 2018-10-11 US claimed
EP-3344250-A2 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE Rexahn Pharmaceuticals, Inc. (US) 2018-07-11 EP claimed
US-20170066726-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE REXAHN PHARMACEUTICALS, INC. (US) 2017-03-09 US claimed
WO-2017040980-A2 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE REXAHN PHARMACEUTICALS, INC. (US) 2017-03-09 WO claimed
US-20200231553-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE REXAHN PHARMACEUTICALS, INC. (US) 2020-07-23 US disclosed
US-20200231553-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE REXAHN PHARMACEUTICALS, INC. (US) 2020-07-23 US disclosed
US-10570101-B2 Quinoxalinyl-piperazinamide methods of use REXAHN PHARMACEUTICALS, INC. (US) 2020-02-25 US disclosed
US-10570101-B2 Quinoxalinyl-piperazinamide methods of use REXAHN PHARMACEUTICALS, INC. (US) 2020-02-25 US disclosed
US-20180290985-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE REXAHN PHARMACEUTICALS, INC. (US) 2018-10-11 US disclosed
EP-3344250-A2 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE Rexahn Pharmaceuticals, Inc. (US) 2018-07-11 EP disclosed
US-9969698-B2 Quinoxalinyl-piperazinamide methods of use REXAHN PHARMACEUTICALS, INC. (US) 2018-05-15 US disclosed
US-20170066726-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE REXAHN PHARMACEUTICALS, INC. (US) 2017-03-09 US disclosed
US-8598173-B2 1-[(6,7-substituted alkoxyquinoxalinyl)aminocarbonyl]-4-(hetero)arylpiperazine derivatives for treating tumors KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2013-12-03 US disclosed
US-20130053390-A1 1-[(6,7-SUBSTITUTED ALKOXYQUINOXALINYL)AMINOCARBONYL]-4-(HETERO)ARYLPIPERAZINE DERIVATIVES REXAHN PHARMACEUTICALS, INC. 2013-02-28 US disclosed
US-8314100-B2 1-[6,7-substituted alkoxyquinoxalinyl)aminocarbonyl]-4-(hetero)arylpiperazine derivatives REXAHN PHARMACEUTICALS, INC. (US) 2012-11-20 US disclosed
EP-1819698-B1 1-[(6-SUBSTITUTED ALKOXYQUINOXALINYL)AMINOCARBONYL]-4-(HETERO)ARYLPIPERAZINE DERIVATIVES REXAHN PHARMACEUTICALS INC (US) 2011-02-23 EP disclosed
US-20080318963-A1 1-[6,7-Substituted Alkoxyquinoxalinyl) Aminocarbonyl]-4-(Hetero) Arylpiperazine Derivatives REXAHN PHARMACEUTICALS, INC. (US) 2008-12-25 US disclosed
EP-1819698-A1 1-[(6,7-SUBSTITUTED ALKOXYQUINOXALINYL)AMINOCARBONYL]-4-(HETERO)ARYLPIPERAZINE DERIVATIVES Rexahn Pharmaceuticals, Inc. (US) 2007-08-22 EP disclosed
WO-2006054830-A1 1-[(6,7-SUBSTITUTED ALKOXYQUINOXALINYL)AMINOCARBONYL]-4-(HETERO)ARYLPIPERAZINE DERIVATIVES REXAHN PHARMACEUTICALS, INC. (US) 2006-05-26 WO 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 (6 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-20080318963-A1 1-[6,7-Substituted Alkoxyquinoxalinyl) Aminocarbonyl]-4-(Hetero) Arylpiperazine Derivatives HRAS, CDK4, KRAS KDM4E 502/4885KMT2A 549/4885BACE1 4848/4885
US-10570101-B2 Quinoxalinyl-piperazinamide methods of use NQO2, CYP3A5, NQO1 KDM4E 3492/4885KMT2A 2050/4885BACE1 2566/4885
US-20180290985-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE NQO2, CYP3A5, NQO1 KDM4E 3492/4885KMT2A 2050/4885BACE1 2566/4885
US-20200231553-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE NQO2, CYP3A5, NQO1 KDM4E 3492/4885KMT2A 2050/4885BACE1 2566/4885
US-20170066726-A1 QUINOXALINYL-PIPERAZINAMIDE METHODS OF USE NQO2, CYP3A5, NQO1 KDM4E 3492/4885KMT2A 2050/4885BACE1 2566/4885
US-20130053390-A1 1-[(6,7-SUBSTITUTED ALKOXYQUINOXALINYL)AMINOCARBONYL]-4-(HETERO)ARYLPIPERAZINE DERIVATIVES HRAS, CDK4, KRAS KDM4E 843/4885KMT2A 814/4885BACE1 4805/4885

“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.