SCHEMBL2203497

SCHEMBL2203497

CCCCCC[N+](=Cc1ccc(C)o1)Cc1ccc(C(N)CCCCN(CCC)CCC)cc1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.35
KCNH2 Q12809 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL2203507 0.78 KDM4E (0.33) SLC2A1KDM4EMAPTESR2
SCHEMBL2203375 0.77 KDM4E (0.34) SLC2A1KDM4EMAPTESR2
SCHEMBL2203504 0.64 ALDH1A1 (0.39) MAPT
SCHEMBL19465403 0.61 SLC2A1 (0.55) SLC2A1KCNH2
SCHEMBL27287382 0.60 KCNH2 (0.58) SLC2A1KCNH2
SCHEMBL4990564 0.60 SLC2A1 (0.60) SLC2A1
SCHEMBL3124987 0.60 SLC2A1 (0.60) SLC2A1
SCHEMBL10589876 0.60 SLC2A1 (0.60) SLC2A1
SCHEMBL4071245 0.60 SLC2A1 (0.60) SLC2A1
SCHEMBL8785774 0.60 SLC2A1 (0.60) SLC2A1

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-7977512-B2 Amine derivative, and production method and use thereof KUREHA CORPORATION (JP) 2011-07-12 US disclosed
US-20080293951-A1 Amin Derivative, and Production Method and Use Thereof KUREHA CORPORATION 2008-11-27 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-20080293951-A1 Amin Derivative, and Production Method and Use Thereof BCAT2, BCAT1, MRPL9 SLC2A1 4155/4885KCNH2 1856/4885KDM4E 1006/4885

“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.