SCHEMBL6492275

SCHEMBL6492275

CCN(CC)C(=O)Oc1cccc(N2CCN(C(=O)c3c4ccccc4nc4ccccc34)CC2)c1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.58
ACACA Q13085 1/20 0.58
KMT2A Q03164 2/20 0.50
LMNA P02545 4/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 2/20 0.48
GAA P10253 1/20 0.48
TSHR P16473 2/20 0.47
RAB9A P51151 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TP53 P04637 1/20 0.46
MEN1 O00255 1/20 0.45
THRB P10828 1/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TSPO P30536 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL6480776 0.86 KMT2A (0.53) ACACBACACAKMT2ALMNAALDH1A1
SCHEMBL6491894 0.85 KMT2A (0.52) ACACBACACAKMT2ALMNAALDH1A1
SCHEMBL18854912 0.85 KMT2A (0.66) KMT2ALMNAALDH1A1KDM4EGAA
SCHEMBL6481517 0.84 KMT2A (0.53) ACACBACACAKMT2ALMNAALDH1A1
SCHEMBL6478995 0.80 KMT2A (0.48) ACACBACACAKMT2ALMNAALDH1A1
SCHEMBL6500007 0.80 ALDH1A1 (0.47) ACACBACACAKMT2ALMNAALDH1A1
SCHEMBL6491981 0.80 KMT2A (0.51) ACACBACACAKMT2ALMNAALDH1A1
SCHEMBL6480462 0.80 KMT2A (0.45) ACACBACACAKMT2ALMNAALDH1A1
SCHEMBL6479986 0.79 KMT2A (0.46) ACACBACACAKMT2ALMNAALDH1A1
SCHEMBL6488791 0.79 KMT2A (0.58) KMT2ALMNAALDH1A1KDM4EGAA

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-20050009809-A1 Aryl- and heteroaryl-substituted piperazinylcarbonyl acridines and their homologs, e.g., (1,3-dihydroxyacridin-9-yl)-[4-(6-methyl pyridin-2-yl )piperazin-1-yl]methanone,are suitable for treating benign and malignant tumors ZENTARIS GMBH (DE) 2005-01-13 US claimed
US-20050009809-A1 Aryl- and heteroaryl-substituted piperazinylcarbonyl acridines and their homologs, e.g., (1,3-dihydroxyacridin-9-yl)-[4-(6-methyl pyridin-2-yl )piperazin-1-yl]methanone,are suitable for treating benign and malignant tumors ZENTARIS GMBH (DE) 2005-01-13 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-20050009809-A1 Aryl- and heteroaryl-substituted piperazinylcarbonyl acridines and their homologs, e.g., (1,3-dihydroxyacridin-9-yl)-[4-(6-methyl pyridin-2-yl )piperazin-1-yl]methanone,are suitable for treating benign and malignant tumors PKD1, MDH2, MSH2 ACACB 2189/4885ACACA 2417/4885KMT2A 1945/4885

“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.