SCHEMBL724966

SCHEMBL724966

Clc1ccnc2cc(-c3cnc4ccccc4c3)oc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 3/20 0.47
PDGFRA P16234 3/20 0.47
GRM4 Q14833 2/20 0.46
CYP2A6 P11509 1/20 0.44
NISCH Q9Y2I1 1/20 0.44
BIRC5 O15392 1/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
BMPR1B O00238 1/20 0.39
PIK3C2G O75747 1/20 0.39
CDKL5 O76039 1/20 0.39
PIM1 P11309 1/20 0.39
TYK2 P29597 1/20 0.39
CLK2 P49760 1/20 0.39
DYRK1A Q13627 1/20 0.39
STK32B Q9NY57 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
IRAK3 Q9Y616 1/20 0.39
NPC1 O15118 1/20 0.38
POLB P06746 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
SCHEMBL722060 0.81 CYP1A1 (0.47) PIM1NPC1RAB9ACYP1A2
SCHEMBL722131 0.76 CYP1A2 (0.44) CYP2A6PIK3CANPC1RAB9ACYP1A2
SCHEMBL10268113 0.75 PIK3CD (0.45) PIK3CDDYRK1ACYP1A2CASP6MAP4K4
SCHEMBL724007 0.73 MAPK14 (0.43) NPC1RAB9ACYP1A2
SCHEMBL721875 0.73 CSNK2A2 (0.40) NPC1RAB9A
SCHEMBL722862 0.73 TDO2 (0.36) NISCHCYP1A2
SCHEMBL723046 0.73 CSNK2A2 (0.36) CYP1A2
SCHEMBL723288 0.72 PBRM1 (0.41) NISCHNPC1POLBRAB9A
SCHEMBL15208962 0.72 MAPT (0.43) CYP1A2
SCHEMBL723593 0.72 LCK (0.41) NPC1RAB9ACASP6MAP4K4MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609100-B1 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-24 EP disclosed
EP-2609100-B1 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-24 EP disclosed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US disclosed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US disclosed
US-9006440-B2 Furopyridine derivatives MERCK PATENT GMBH (DE) 2015-04-14 US disclosed
US-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
US-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
EP-2609100-A2 FUROPYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP disclosed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO disclosed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 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-20130225569-A1 FUROPYRIDINE DERIVATIVES SYK, FCGRT, SSB PDGFRB 324/4885PDGFRA 327/4885GRM4 4357/4885

“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.