SCHEMBL11949067

SCHEMBL11949067

CCN(CC)c1cc2[nH]c(-c3ccccc3OC)nc2cc1NC(=O)C1CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.47
▸ ABL1 P00519 1/20 0.46
▸ MAPK14 Q16539 2/20 0.45
▸ GSK3B P49841 2/20 0.44
▸ GSK3A P49840 1/20 0.44
▸ JAK2 O60674 2/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ JAK1 P23458 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ PARP1 P09874 2/20 0.42
▸ DHODH Q02127 1/20 0.42
▸ PDE5A O76074 2/20 0.41
▸ TNKS O95271 1/20 0.41
▸ BRPF1 P55201 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ POLB P06746 1/20 0.41

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
SCHEMBL11948986 0.96 SMN1; SMN2 (0.48) KMT2AABL1MAPK14GSK3BGSK3A
SCHEMBL15275517 0.96 SMN1; SMN2 (0.46) KMT2AABL1MAPK14GSK3BGSK3A
SCHEMBL11949060 0.95 SMN1; SMN2 (0.50) KMT2AABL1MAPK14HDAC6SMN1; SMN2
SCHEMBL14046899 0.88 KMT2A (0.51) KMT2AABL1JAK2SMN1; SMN2HTT
SCHEMBL11949046 0.88 ALOX15 (0.48) ABL1HDAC6PARP1PDE5ABRPF1
SCHEMBL11948989 0.88 ABL1 (0.47) ABL1HDAC6PARP1PDE5ABRPF1
SCHEMBL11949062 0.85 BRPF1 (0.58) KMT2AABL1HDAC6SMN1; SMN2PARP1
SCHEMBL11948998 0.85 HDAC6 (0.48) KMT2AABL1HDAC6SMN1; SMN2PDE5A
SCHEMBL11949064 0.85 ABL1 (0.45) KMT2AABL1HDAC6SMN1; SMN2PARP1
SCHEMBL11949051 0.85 ADORA3 (0.50) ABL1HDAC6PARP1PDE5ABRPF1

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
US-8232410-B2 Benzimidazoles and pharmaceutical compositions thereof THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2012-07-31 — — US disclosed
US-8232410-B2 Benzimidazoles and pharmaceutical compositions thereof THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2012-07-31 — — US disclosed
US-20100256203-A1 BENZIMIDAZOLES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2010-10-07 — — US disclosed
US-20100256203-A1 BENZIMIDAZOLES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2010-10-07 — — 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-20100256203-A1 BENZIMIDAZOLES AND PHARMACEUTICAL COMPOSITIONS THEREOF TBCD, TBC1D5, CFTR KMT2A 3023/4885ABL1 22/4885MAPK14 2103/4885

“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.

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