SCHEMBL1663396

SCHEMBL1663396

COc1ccc2nncc(Cl)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
PIK3CD O00329 1/20 0.42
PDE4A P27815 4/20 0.41
PDE4B Q07343 4/20 0.41
PDE4C Q08493 4/20 0.41
PDE4D Q08499 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
KDM4E B2RXH2 5/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 2/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
NQO2 P16083 1/20 0.41
RAB9A P51151 1/20 0.41
CYP17A1 P05093 2/20 0.40
CYP11B1 P15538 2/20 0.40

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
SCHEMBL3375367 0.86 CYP1A2 (0.42) CNR1CNR2PDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL6098200 0.85 CYP3A4 (0.41) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL1663614 0.79 TRIM24 (0.46) SMN1; SMN2KDM4ELMNAPOLBMEN1
SCHEMBL29923830 0.79 KDM4E (0.41) SMN1; SMN2KDM4ELMNAPOLBMEN1
SCHEMBL29923693 0.79 TRIM24 (0.46) SMN1; SMN2KDM4ELMNAPOLBMEN1
SCHEMBL24915825 0.79 KDM4E (0.41) SMN1; SMN2KDM4ELMNAPOLBMEN1
SCHEMBL11195737 0.77 KDM4E (0.52) SMN1; SMN2KDM4ELMNAPOLBMEN1
SCHEMBL24916024 0.77 CNR1 (0.41) CNR1CNR2SMN1; SMN2KDM4ELMNA
SCHEMBL30950666 0.76 SMN1; SMN2 (0.43) CNR1CNR2PIK3CDSMN1; SMN2TP53
SCHEMBL6096600 0.76 SMN1; SMN2 (0.43) CNR1CNR2PIK3CDSMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9303026-B2 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2016-04-05 US disclosed
US-20140179709-A1 ANTIVIRAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2014-06-26 US disclosed
US-8624025-B2 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2014-01-07 US disclosed
US-20130005736-A1 ANTIVIRAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-01-03 US disclosed
US-8217171-B2 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2012-07-10 US disclosed
US-20110212966-A1 ANTIVIRAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2011-09-01 US disclosed
US-7951955-B2 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2011-05-31 US disclosed
EP-2314582-A1 Heterocyclic compounds as antiviral agents Biota Scientific Management Pty Ltd (AU) 2011-04-27 EP disclosed
US-7829705-B2 such as 7-{2-[1-(6-methyl-3-pyridazinyl)-4-piperidinyl]ethoxy}-4-ethoxy-cinnoline, used in the treatment of picornavirus infections in humans BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2010-11-09 US disclosed
US-7579465-B2 For treatment of picornavirus infections in mammals BIOTA SCIENTIFIC MANAGMENT PTY. LTD. (AU) 2009-08-25 US disclosed
US-20090030000-A1 ANTIVIRAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2009-01-29 US disclosed
US-20070149531-A1 such as 7-{2-[1-(6-methyl-3-pyridazinyl)-4-piperidinyl]ethoxy}-4-ethoxy-cinnoline, used in the treatment of picornavirus infections in humans BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2007-06-28 US disclosed
US-20070149530-A1 For treatment of picornavirus infections in mammals BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2007-06-28 US disclosed
US-7166604-B2 N-Heterocyclic derivatives; picornavirus infections in mammals; human rhinovirus BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2007-01-23 US disclosed
EP-1353911-A4 ANTIVIRAL AGENTS BIOTA SCIENT MANAGEMENT (AU) 2005-01-05 EP disclosed
US-20040077633-A1 N-Heterocyclic derivatives; picornavirus infections in mammals; human rhinovirus BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2004-04-22 US disclosed
EP-1353911-A1 ANTIVIRAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2003-10-22 EP disclosed
WO-2002050045-A1 ANTIVIRAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2002-06-27 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 (7 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-20070149530-A1 For treatment of picornavirus infections in mammals HAVCR2, EIF2AK2, MAVS CNR1 4042/4885CNR2 4557/4885PIK3CD 4502/4885
US-20090030000-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 CNR1 4564/4885CNR2 4836/4885PIK3CD 2257/4885
US-20130005736-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 CNR1 4564/4885CNR2 4836/4885PIK3CD 2257/4885
US-20110212966-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 CNR1 4564/4885CNR2 4836/4885PIK3CD 2257/4885
US-20070149531-A1 such as 7-{2-[1-(6-methyl-3-pyridazinyl)-4-piperidinyl]ethoxy}-4-ethoxy-cinnoline, used in the treatment of picornavirus infections in humans EIF2AK2, IFNAR1, HAVCR2 CNR1 238/4885CNR2 734/4885PIK3CD 3502/4885
US-20140179709-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 CNR1 4564/4885CNR2 4836/4885PIK3CD 2257/4885
US-20040077633-A1 N-Heterocyclic derivatives; picornavirus infections in mammals; human rhinovirus RNASEH1, RPL35, SARS1 CNR1 1935/4885CNR2 3496/4885PIK3CD 4299/4885

“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.