SCHEMBL4767285

SCHEMBL4767285

O=Cc1c(-c2ccccc2)ncn1CCN1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.60
TEK Q02763 1/20 0.60
PTGS2 P35354 4/20 0.44
KDM5B Q9UGL1 2/20 0.43
SIGMAR1 Q99720 1/20 0.43
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
LTA4H P09960 1/20 0.40
HRH3 Q9Y5N1 4/20 0.40
HRH1 P35367 1/20 0.39
KCNH2 Q12809 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39

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
SCHEMBL4774678 0.76 TEK (1.00) KDRTEKADORA2AADORA1
SCHEMBL4774681 0.76 TEK (1.00) KDRTEKADORA2AADORA1
SCHEMBL4774618 0.76 TEK (0.56) KDRTEKPTGS2
SCHEMBL4764904 0.74 PTGS2 (0.66) KDRTEKPTGS2KDM4E
SCHEMBL4764875 0.71 KDR (0.52) KDRTEKPTGS2KDM4E
SCHEMBL4796428 0.68 CYP11B2 (0.53) KDRTEKPTGS2SIGMAR1KDM4E
SCHEMBL18098557 0.65 TDP1 (0.71) SIGMAR1HRH3HRH1
SCHEMBL3414135 0.65 HDAC1 (0.53) KDRKDM4EHRH3HRH1
SCHEMBL31094938 0.65 DRD2 (0.63) KDM4ETP53POLBCYP1A2CYP2D6
SCHEMBL4961612 0.65 SMN1; SMN2 (0.46) KDM4E

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 4 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
EP-1575963-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2005-09-21 EP disclosed
WO-2004058776-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2004-07-15 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-20060069109-A1 Therapeutic agents TIE1, TEK, KDR KDR 3/4885TEK 2/4885PTGS2 112/4885

“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.