SCHEMBL4581917

SCHEMBL4581917

[CH2]c1cccc(-n2cnnn2)c1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.60
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
KMT2A Q03164 7/20 0.50
F2 P00734 1/20 0.47
MAPT P10636 1/20 0.47
MEN1 O00255 3/20 0.47

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
SCHEMBL21152328 0.86 NOTUM (0.72) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL3369534 0.78 NOTUM (0.60) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL3891046 0.78 NOTUM (0.60) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL29556202 0.78 MAPT (0.61) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL21150838 0.78 NOTUM (0.63) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL1960697 0.78 MAPT (0.61) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL3819681 0.78 NOTUM (0.61) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL5168614 0.78 NOTUM (0.60) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL10627585 0.78 NOTUM (0.60) NOTUMLMNATP53SMN1; SMN2KMT2A
SCHEMBL1353899 0.78 NOTUM (0.60) NOTUMLMNATP53SMN1; SMN2KMT2A

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
US-8362017-B2 N-[5-chloro-2-(methyloxy)phenyl]-2-{[3-(1H-tetrazol-1-yl)phenyl]oxy}acetamide; antiproliferative agents; protein kinase inhibitors; drug screening EXELIXIS, INC. (US) 2013-01-29 US disclosed
US-20080096892-A1 C-Kit Modulators And Methods Of Use EXELIXIS, INC. (US) 2008-04-24 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-20080096892-A1 C-Kit Modulators And Methods Of Use KIT, PRKCH, PRKCB NOTUM 3734/4885LMNA 922/4885TP53 1271/4885

“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.