SCHEMBL4767231

SCHEMBL4767231

Cn1cnc(-c2ccccc2)c1C=Cc1ccncc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.59
TEK Q02763 6/20 0.59
FLT1 P17948 3/20 0.59
NSD3 Q9BZ95 1/20 0.57
MAPK14 Q16539 1/20 0.41
PRKD3 O94806 1/20 0.40
MAP4K4 O95819 1/20 0.40
FRK P42685 1/20 0.40
MAPK9 P45984 1/20 0.40
CSNK1A1 P48729 1/20 0.40
CSNK1D P48730 1/20 0.40
GSK3B P49841 1/20 0.40
PRKD2 Q9BZL6 1/20 0.40
MAP4K5 Q9Y4K4 1/20 0.40
IP6K1 Q92551 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
NOTUM Q6P988 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL4767226 1.00 KDR (0.59) KDRTEKFLT1NSD3MAPK14
SCHEMBL4774512 0.83 TEK (0.67) KDRTEKFLT1NSD3MAPK14
SCHEMBL4774516 0.83 TEK (0.67) KDRTEKFLT1NSD3MAPK14
SCHEMBL4764875 0.74 KDR (0.52) KDRTEKFLT1NSD3NPC1
SCHEMBL4774487 0.74 TEK (0.77) KDRTEKFLT1NSD3
SCHEMBL4771725 0.74 TEK (1.00) KDRTEKFLT1MAPTKDM4E
SCHEMBL4771720 0.74 TEK (1.00) KDRTEKFLT1MAPTKDM4E
SCHEMBL4774491 0.74 TEK (0.77) KDRTEKFLT1NSD3
SCHEMBL4584865 0.73 NSD3 (1.00) KDRTEKFLT1NSD3MAPK14
SCHEMBL27619837 0.72 TEK (0.70) KDRTEKFLT1NSD3MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1575963-B1 ANTI-ANGIOGENETIC THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2008-05-07 EP disclosed
US-20060069109-A1 Therapeutic agents ASTRAZENECA AB (SE) 2006-03-30 US 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-20060069109-A1 Therapeutic agents TIE1, TEK, KDR KDR 3/4885TEK 2/4885FLT1 4/4885

“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.