SCHEMBL4486162

SCHEMBL4486162

N#Cc1ccc(Nc2nccc(O)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.58
SCN5A Q14524 1/20 0.58
SCN9A Q15858 1/20 0.58
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
SYK P43405 2/20 0.52
IKBKB O14920 3/20 0.52
CYP2C19 P33261 4/20 0.49
CYP2C9 P11712 3/20 0.49
GSK3B P49841 3/20 0.49
CDK2 P24941 3/20 0.49
CYP3A4 P08684 2/20 0.49
JAK2 O60674 2/20 0.49
CDK4 P11802 2/20 0.49
DYRK1A Q13627 1/20 0.49
AURKA O14965 2/20 0.49
ABCG2 Q9UNQ0 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
MAPT P10636 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
SCHEMBL28499240 0.85 KCNH2 (0.48) KCNH2SCN5ASCN9AMEN1KMT2A
SCHEMBL2296305 0.83 KCNH2 (0.42) KCNH2SCN5ASCN9AMEN1KMT2A
SCHEMBL249084 0.81 SYK (0.49) KCNH2SCN5ASCN9ASYKCYP2C19
SCHEMBL2864184 0.81 CYP2C19 (0.56) KCNH2SCN5ASCN9AMEN1KMT2A
SCHEMBL13713315 0.81 KCNH2 (0.58) KCNH2SCN5ASCN9AMEN1KMT2A
SCHEMBL867999 0.81 KCNH2 (0.58) KCNH2SCN5ASCN9AMEN1KMT2A
SCHEMBL3697392 0.81 KCNH2 (0.58) KCNH2SCN5ASCN9AMEN1KMT2A
SCHEMBL10177401 0.81 SCN9A (0.84) KCNH2SCN5ASCN9AMEN1KMT2A
SCHEMBL18656973 0.80 KCNH2 (0.54) KCNH2SCN5ASCN9AMEN1KMT2A
SCHEMBL1741981 0.79 KCNH2 (0.55) KCNH2SCN5ASCN9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2702044-B1 PROCESS FOR RILPIVIRINE HETERO RESEARCH FOUNDATION (IN) 2017-03-22 EP claimed
US-20140228385-A1 PROCESS FOR RILPIVIRINE HETERO RESEARCH FOUNDATION (IN) 2014-08-14 US claimed
EP-2702044-A2 PROCESS FOR RILPIVIRINE Hetero Research Foundation (IN) 2014-03-05 EP claimed
WO-2012147091-A2 PROCESS FOR RILPIVIRINE HETERO RESEARCH FOUNDATION (IN) 2012-11-01 WO claimed
CN-116675649-A Novel process for efficiently and safely synthesizing rilpivirine intermediate 中科苏州药物研究院 2023-09-01 CN disclosed
EP-2755959-B1 RILPIVIRINE HYDROCHLORIDE HETERO RESEARCH FOUNDATION (IN) 2018-05-16 EP disclosed
EP-2702044-B1 PROCESS FOR RILPIVIRINE HETERO RESEARCH FOUNDATION (IN) 2017-03-22 EP disclosed
EP-2643294-B1 AN IMPROVED RILPIVIRINE PROCESS EMCURE PHARMACEUTICALS LTD (IN) 2016-08-24 EP disclosed
EP-2643294-B1 AN IMPROVED RILPIVIRINE PROCESS EMCURE PHARMACEUTICALS LTD (IN) 2016-08-24 EP disclosed
US-9233935-B2 Rilpivirine hydrochloride HETERO RESEARCH FOUNDATION (IN) 2016-01-12 US disclosed
US-9126949-B2 Process for rilpivirine HETERO RESEARCH FOUNDATION (IN) 2015-09-08 US disclosed
US-9126949-B2 Process for rilpivirine HETERO RESEARCH FOUNDATION (IN) 2015-09-08 US disclosed
US-20110152303-A1 Chemical Compounds GLAXOSMITHKLINE LLC (US) 2011-06-23 US disclosed
US-20110152303-A1 Chemical Compounds GLAXOSMITHKLINE LLC (US) 2011-06-23 US disclosed
US-7514445-B2 Heteroaryl amines as glycogen synthase kinase 3β inhibitors (GSK3 inhibitors) JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-07 US disclosed
US-20080171878-A1 Process for Preparing 4-[(1,6-Dihydro-6-Oxo-2-Pyrimidinyl)Amino]Benzonitrile JANSSEN SCIENCES IRELAND UC (IE) 2008-07-17 US disclosed
US-20080171878-A1 Process for Preparing 4-[(1,6-Dihydro-6-Oxo-2-Pyrimidinyl)Amino]Benzonitrile JANSSEN SCIENCES IRELAND UC (IE) 2008-07-17 US disclosed
US-20050004125-A1 Heteroaryl amines as glycogen synthase kinase 3beta inhibitors (gsk3 inhibitors) JANSSEN PHARMACEUTICA N.V. (BE) 2005-01-06 US disclosed
EP-1448556-A1 HETEROARYL AMINES AS GLYCOGEN SYNTHASE KINASE 3BETA INHIBITORS (GSK3 INHIBITORS) JANSSEN PHARMACEUTICA N.V. (BE) 2004-08-25 EP disclosed
WO-2003037891-A1 HETEROARYL AMINES AS GLYCOGEN SYNTHASE KINASE 3BETA INHIBITORS (GSK3 INHIBITORS) JANSSEN PHARMACEUTICA N.V. (BE) 2003-05-08 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 (4 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-20080171878-A1 Process for Preparing 4-[(1,6-Dihydro-6-Oxo-2-Pyrimidinyl)Amino]Benzonitrile ME1, ALKBH1, DPYD KCNH2 985/4885SCN5A 2879/4885SCN9A 2721/4885
US-20110152303-A1 Chemical Compounds TYMP, SAMHD1, DPYD KCNH2 2986/4885SCN5A 3811/4885SCN9A 3231/4885
US-20140228385-A1 PROCESS FOR RILPIVIRINE SAMHD1, EIF2AK2, IL4 KCNH2 2546/4885SCN5A 1853/4885SCN9A 3784/4885
US-20050004125-A1 Heteroaryl amines as glycogen synthase kinase 3beta inhibitors (gsk3 inhibitors) GSK3B, GSK3A, GSKIP KCNH2 987/4885SCN5A 839/4885SCN9A 493/4885

“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.