SCHEMBL5466956

SCHEMBL5466956

CC(=O)Nc1cccc(-c2ccnc(NC(=O)c3ccccc3)n2)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.72
PLK1 P53350 1/20 0.65
ABL1 P00519 6/20 0.63
BCR P11274 6/20 0.63
PRKCA P17252 4/20 0.63
PDGFRB P09619 4/20 0.63
PDGFRA P16234 4/20 0.63
SRC P12931 3/20 0.63
PRKCD Q05655 3/20 0.63
PRKD3 O94806 1/20 0.63
PRKCG P05129 1/20 0.63
PRKCB P05771 1/20 0.63
PRKCH P24723 1/20 0.63
PRKCI P41743 1/20 0.63
PRKCE Q02156 1/20 0.63
PRKCQ Q04759 1/20 0.63
PRKCZ Q05513 1/20 0.63
PRKD1 Q15139 1/20 0.63
JAK3 P52333 1/20 0.59
POLB P06746 1/20 0.57

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
SCHEMBL5472892 0.87 JAK2 (0.76) JAK2JAK3POLBKMT2AMAPK8
SCHEMBL4733852 0.87 PLK1 (0.84) JAK2PLK1ABL1BCRPRKCA
SCHEMBL4376512 0.84 PLK1 (0.72) JAK2PLK1ABL1BCRPRKCA
SCHEMBL4378752 0.84 JAK2 (1.00) JAK2PLK1ABL1BCRPRKCA
SCHEMBL5470852 0.84 ADORA1 (0.69) JAK2ABL1BCRPRKCAPDGFRB
SCHEMBL5463021 0.82 ABL1 (0.66) JAK2PLK1ABL1PDGFRBPDGFRA
SCHEMBL5462697 0.82 ALDH1A1 (0.58) JAK2ABL1BCRPRKCAPDGFRB
SCHEMBL19706531 0.79 NPC1 (0.71) JAK2PLK1JAK3POLBKMT2A
SCHEMBL5465350 0.79 SIRT2 (0.68) JAK2ABL1BCRPRKCAPDGFRB
SCHEMBL4736493 0.79 PLK1 (0.83) JAK2PLK1ABL1BCRPRKCA

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-20070099938-A1 Antistress drug and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-03 US disclosed
EP-1679309-A1 ANTISTRESS DRUG AND MEDICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP 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-20070099938-A1 Antistress drug and medical use thereof NPSR1, MC2R, SRR JAK2 2119/4885PLK1 3377/4885ABL1 1671/4885

“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.