SCHEMBL4980460

SCHEMBL4980460

CCN(CC)CCCNc1cc(OCCCN(CC)CC)ccc1N

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
APP P05067 1/20 0.48
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
MAOB P27338 4/20 0.46
SIGMAR1 Q99720 1/20 0.43
MAOA P21397 1/20 0.43
XDH P47989 2/20 0.42
MAPT P10636 1/20 0.42
CHRNA7 P36544 1/20 0.42
KMT2A Q03164 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
SCHEMBL1283645 0.95 KDM4E (0.50) KDM4EAPPHSP90AA1HSP90AB1MAOB
SCHEMBL4980706 0.93 KDM4E (0.51) KDM4EAPPMAOBSIGMAR1MAOA
SCHEMBL4983089 0.90 KDM4E (0.54) KDM4EMAOBSIGMAR1MAOAXDH
SCHEMBL4984307 0.84 KDM4E (0.50) KDM4EAPPMAOBSIGMAR1MAOA
SCHEMBL4983140 0.81 KDM4E (0.62) KDM4EMAOBSIGMAR1MAOAXDH
SCHEMBL4980649 0.79 SIRT5 (0.54) KDM4EAPPMAOBMAPT
SCHEMBL2891337 0.79 KDM4E (0.59) KDM4EMAOBSIGMAR1MAOAXDH
SCHEMBL1284030 0.77 LTA4H (0.41) HSP90AA1HSP90AB1
SCHEMBL2891507 0.76 CYP1A2 (0.60) KDM4EMAOBSIGMAR1XDH
SCHEMBL5240129 0.76 KDM4E (0.56) KDM4EMAOBSIGMAR1MAOAXDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080119534-A1 Benzimidazole Derivatives as Therapeutic Agents TRANS TECH PHARMA, INC (US) 2008-05-22 US disclosed
US-7329684-B2 Benzimidazole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2008-02-12 US disclosed
US-7087632-B2 Benzimidazole derivatives as therapeutic agents TRANSTECH PHARMA, INC. (US) 2006-08-08 US disclosed
US-20060025464-A1 Benzimidazole derivatives as therapeutic agents TRANSTECH PHARMA, LLC 2006-02-02 US disclosed
EP-1387680-A1 BENZIMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS TransTech Pharma Inc. (US) 2004-02-11 EP disclosed
US-20030032663-A1 Benzimidazole derivatives as therapeutic agents TRANSTECH PHARMA, LLC 2003-02-13 US disclosed
WO-2002069965-A1 BENZIMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS TRANSTECH PHARMA, INC. (US) 2002-09-12 WO 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 (3 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-20080119534-A1 Benzimidazole Derivatives as Therapeutic Agents AGER, S100B, S100A4 KDM4E 3269/4885APP 106/4885HSP90AA1 1387/4885
US-20030032663-A1 Benzimidazole derivatives as therapeutic agents AGER, S100B, S100A4 KDM4E 3282/4885APP 96/4885HSP90AA1 1262/4885
US-20060025464-A1 Benzimidazole derivatives as therapeutic agents AGER, S100B, S100A4 KDM4E 3269/4885APP 106/4885HSP90AA1 1387/4885

“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.