SCHEMBL7532243

SCHEMBL7532243

O=CNc1cccc(-c2n[nH]c3ccc(-c4nn[nH]n4)cc23)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.48
PFKFB3 Q16875 7/20 0.47
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
USP2 O75604 1/20 0.43
PFKFB4 Q16877 3/20 0.43
NPC1 O15118 1/20 0.43
CLK1 P49759 1/20 0.43
RAB9A P51151 1/20 0.43
CHEK1 O14757 1/20 0.43
AURKA O14965 1/20 0.42

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
SCHEMBL14514447 0.79 MAPT (0.56) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL5381308 0.79 MAPT (0.56) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL5386051 0.79 GP6 (0.48) ALDH1A1MAPTCHEK1
SCHEMBL5372659 0.79 AURKA (0.58) ALDH1A1MAPTCHEK1AURKA
SCHEMBL5374376 0.79 MAPT (0.55) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL5374202 0.78 AURKA (0.52) MAPTMEN1POLBKMT2AUSP2
SCHEMBL7533484 0.77 MAP2K4 (0.59) AURKA
SCHEMBL5375007 0.77 MAPT (0.51) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL5383308 0.76 KMT2A (0.56) MAPTMEN1POLBKMT2AUSP2
SCHEMBL5379422 0.76 XDH (0.67) ALDH1A1MAPTPFKFB3PFKFB4CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, LLC 2002-08-01 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-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 ALDH1A1 2864/4885MAPT 1000/4885PFKFB3 1583/4885

“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.