SCHEMBL4983140

SCHEMBL4983140

CCN(CC)CCCOc1ccc(N)c(N)c1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.62
MAOB P27338 4/20 0.54
SIGMAR1 Q99720 1/20 0.50
MAOA P21397 1/20 0.49
MAPT P10636 1/20 0.49
CHRNA7 P36544 1/20 0.49
KMT2A Q03164 1/20 0.49
XDH P47989 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL11709795 0.91 KDM4E (0.52) KDM4EMAOBSIGMAR1MAOA
SCHEMBL2891337 0.87 KDM4E (0.59) KDM4EMAOBSIGMAR1MAOAMAPT
SCHEMBL11720146 0.86 MAOB (0.49) KDM4EMAOBMAOA
SCHEMBL5240129 0.84 KDM4E (0.56) KDM4EMAOBSIGMAR1MAOAMAPT
SCHEMBL2891507 0.84 CYP1A2 (0.60) KDM4EMAOBSIGMAR1XDHTSHR
SCHEMBL20982486 0.83 KDM4E (0.58) KDM4EMAOA
SCHEMBL11715546 0.83 NR4A1 (0.52) KDM4EMAOBSIGMAR1MAPTCHRNA7
SCHEMBL4983089 0.82 KDM4E (0.54) KDM4EMAOBSIGMAR1MAOAMAPT
SCHEMBL11709998 0.82 KDM4E (0.55) KDM4EMAOBSIGMAR1MAPTCHRNA7
SCHEMBL11655575 0.82 TSHR (0.53) KDM4EMAPTKMT2ATSHR

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 3269/4885MAOB 1721/4885SIGMAR1 2694/4885
US-20030032663-A1 Benzimidazole derivatives as therapeutic agents AGER, S100B, S100A4 KDM4E 3282/4885MAOB 1747/4885SIGMAR1 2866/4885
US-20060025464-A1 Benzimidazole derivatives as therapeutic agents AGER, S100B, S100A4 KDM4E 3269/4885MAOB 1721/4885SIGMAR1 2694/4885

“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.