SCHEMBL3876110

SCHEMBL3876110

O=C(Nc1ccc2cn[nH]c2c1)c1ccccc1NCc1ccnc(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
HPGD P15428 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
JAK2 O60674 2/20 0.55
JAK1 P23458 1/20 0.55
KDR P35968 12/20 0.52
FLT1 P17948 4/20 0.52
KIT P10721 4/20 0.49
BRAF P15056 3/20 0.49
CFTR P13569 1/20 0.48
PLK4 O00444 1/20 0.48
CHEK1 O14757 1/20 0.48
MAPK13 O15264 1/20 0.48
PDPK1 O15530 1/20 0.48
DAPK3 O43293 1/20 0.48
DYRK3 O43781 1/20 0.48
ROCK2 O75116 1/20 0.48
PRKD3 O94806 1/20 0.48
MAP4K4 O95819 1/20 0.48

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
SCHEMBL3869371 0.93 JAK2 (0.66) NPC1RAB9AJAK2JAK1KDR
SCHEMBL4034467 0.88 NPC1 (0.55) NPC1RAB9AHPGDSMN1; SMN2JAK2
SCHEMBL6543870 0.87 KIT (0.63) NPC1RAB9AHPGDSMN1; SMN2JAK2
SCHEMBL4034472 0.85 NPC1 (0.52) NPC1RAB9AHPGDSMN1; SMN2JAK2
SCHEMBL4042755 0.85 NPC1 (0.52) NPC1RAB9AHPGDSMN1; SMN2JAK2
SCHEMBL3870092 0.81 FLT1 (0.48) KDRFLT1KITBRAFCSF1R
SCHEMBL3868951 0.81 JAK2 (0.66) NPC1RAB9AJAK2JAK1KDR
SCHEMBL6543933 0.80 JAK2 (0.64) NPC1RAB9AJAK2JAK1KDR
SCHEMBL6786372 0.80 KDR (0.57) NPC1RAB9AHPGDSMN1; SMN2JAK2
SCHEMBL3864318 0.79 NOTUM (0.49) KDRFLT1KITBRAF

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-7615565-B2 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-11-10 US disclosed
US-7615565-B2 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-11-10 US disclosed
US-7615565-B2 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-11-10 US disclosed
EP-1392680-B1 SELECTIVE ANTHRANILAMIDE PYRIDINE AMIDES AS INHIBITORS OF VEGFR-2 AND VEGFR-3 BAYER SCHERING PHARMA AG (DE) 2009-07-22 EP disclosed
US-7517894-B2 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER SCHERING PHARMA AG (DE) 2009-04-14 US disclosed
US-7517894-B2 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER SCHERING PHARMA AG (DE) 2009-04-14 US disclosed
US-7517894-B2 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER SCHERING PHARMA AG (DE) 2009-04-14 US disclosed
US-20070015794-A1 Endothelial growth factor; angiogenesis inhibitors; antitumor agents; skin disorders; endimetriosis; Crohn's disease; leukemia; antiarthritic agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-18 US disclosed
US-20070015794-A1 Endothelial growth factor; angiogenesis inhibitors; antitumor agents; skin disorders; endimetriosis; Crohn's disease; leukemia; antiarthritic agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-18 US disclosed
US-20070015794-A1 Endothelial growth factor; angiogenesis inhibitors; antitumor agents; skin disorders; endimetriosis; Crohn's disease; leukemia; antiarthritic agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-18 US disclosed
US-7148357-B2 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines SCHERING AG (DE) 2006-12-12 US disclosed
EP-1594841-A1 VEGFR-2 AND VEGFR-3 INHIBITORY ANTHRANYLAMIDOPYRIDINES SCHERING AKTIENGESELLSCHAFT (DE) 2005-11-16 EP disclosed
CN-1671666-A VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridine compounds SCHERING AG (DE) 2005-09-21 CN disclosed
US-20050054654-A1 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2005-03-10 US disclosed
US-20040254185-A1 Selective anthranilamide pyridine amides as inhibitors of vegfr-2 and vegfr-3 BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-12-16 US disclosed
CN-1518546-A Selective anthranilamide picolinamides as VEGRF-2 and VEGFR-3 inhibitors ���ֹɷݹ�˾ 2004-08-04 CN disclosed
US-20040147535-A1 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-07-29 US disclosed
WO-2004013102-A1 VEGFR-2 AND VEGFR-3 INHIBITORY ANTHRANYLAMIDOPYRIDINES SCHERING AKTIENGESELLSCHAFT (DE) 2004-02-12 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-20070015794-A1 Endothelial growth factor; angiogenesis inhibitors; antitumor agents; skin disorders; endimetriosis; Crohn's disease; leukemia; antiarthritic agents FLT4, KDR, FLT1 NPC1 4870/4885RAB9A 2587/4885HPGD 2911/4885
US-20040254185-A1 Selective anthranilamide pyridine amides as inhibitors of vegfr-2 and vegfr-3 FLT4, KDR, FLT1 NPC1 4864/4885RAB9A 1818/4885HPGD 2323/4885
US-20040147535-A1 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines FLT4, KDR, FLT1 NPC1 4839/4885RAB9A 1702/4885HPGD 2498/4885
US-20050054654-A1 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines FLT4, KDR, FLT1 NPC1 4841/4885RAB9A 1703/4885HPGD 2493/4885

“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.