SCHEMBL2192371

SCHEMBL2192371

COc1ccc(-n2cc(-c3ccccn3)nn2)cc1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 4/20 0.72
MIF P14174 3/20 0.68
GSK3B P49841 1/20 0.57
PTGS2 P35354 2/20 0.52
GRM5 P41594 1/20 0.52
PTGS1 P23219 1/20 0.52
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA5A P35218 2/20 0.51
CA5B Q9Y2D0 2/20 0.51
P2RX7 Q99572 1/20 0.50
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49
CYP1B1 Q16678 1/20 0.49
STIM1 Q13586 2/20 0.46
ORAI1 Q96D31 2/20 0.46
METAP1 P53582 1/20 0.46
KDR P35968 1/20 0.43

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
SCHEMBL26628309 0.85 STIM1 (0.60) FLT3MIFGSK3BPTGS2GRM5
SCHEMBL21122014 0.84 PTGS2 (0.56) FLT3MIFPTGS2PTGS1CA1
SCHEMBL29158520 0.84 FLT3 (1.00) FLT3MIFGSK3BPTGS2GRM5
SCHEMBL6953018 0.83 FLT3 (0.77) FLT3MIFGSK3BPTGS2GRM5
SCHEMBL2190307 0.81 PTGS2 (0.67) FLT3PTGS2PTGS1CA1CA2
SCHEMBL1674373 0.81 FLT3 (0.73) FLT3MIFGSK3BPTGS2GRM5
SCHEMBL17980671 0.81 MIF (1.00) FLT3MIFGSK3BGRM5
SCHEMBL28464554 0.81 FLT3 (0.73) FLT3MIFGSK3BPTGS2GRM5
SCHEMBL29199654 0.80 FLT3 (0.72) FLT3MIFGSK3BPTGS2GRM5
SCHEMBL27903094 0.79 PTGS2 (0.76) FLT3GSK3BPTGS2PTGS1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111771001-A Enhanced nucleic acid polymerization by aromatic compounds 斯特拉托斯基因公司 2020-10-13 CN claimed
US-20110172417-A1 Heterogeneous Copper Nanocatalyst and Manufacturing Methods Thereof POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2011-07-14 US claimed
US-9375705-B2 Heterogeneous copper nanocatalyst and manufacturing methods thereof POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2016-06-28 US disclosed
US-8877676-B2 Heterogeneous copper nanocatalyst and manufacturing methods thereof POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2014-11-04 US disclosed
US-8877676-B2 Heterogeneous copper nanocatalyst and manufacturing methods thereof POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2014-11-04 US disclosed
US-8877676-B2 Heterogeneous copper nanocatalyst and manufacturing methods thereof POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2014-11-04 US disclosed
US-20140302984-A1 HETEROGENEOUS COPPER NANOCATALYST AND MANUFACTURING METHODS THEREOF POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2014-10-09 US disclosed
US-20110172417-A1 Heterogeneous Copper Nanocatalyst and Manufacturing Methods Thereof POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2011-07-14 US disclosed
US-20110172417-A1 Heterogeneous Copper Nanocatalyst and Manufacturing Methods Thereof POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2011-07-14 US disclosed
US-20110172417-A1 Heterogeneous Copper Nanocatalyst and Manufacturing Methods Thereof POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2011-07-14 US disclosed
WO-2010005127-A2 HETEROGENEOUS COPPER NANOCATALYST AND MANUFACTURING METHODS THEREOF POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2010-01-14 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 (1 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-20110172417-A1 Heterogeneous Copper Nanocatalyst and Manufacturing Methods Thereof AOC3, AOC2, USP13 FLT3 1759/4885MIF 3656/4885GSK3B 3842/4885

“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.