SCHEMBL16495161

SCHEMBL16495161

CN1CCC(CN(C(=O)O)c2ccc3c(c2)CCN3Cc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 12/20 0.50
TNF P01375 1/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL16495343 0.90 ACHE (0.45) ACHETNF
SCHEMBL16494800 0.82 ACHE (0.38) ACHETNF
SCHEMBL16495267 0.80 MAPT (0.47) TNF
SCHEMBL16495163 0.78 TNF (0.43) ACHETNF
SCHEMBL16495220 0.75 MAPT (0.46) ACHETNF
SCHEMBL16494753 0.75 CAPN1 (0.42) ACHETNF
Methane SCHEMBL27429811 0.75 TNF (0.46) ACHETNF
SCHEMBL16495164 0.74 HDAC1 (0.44) ACHETNF
SCHEMBL27429810 0.74 TNF (0.45) ACHETNF
SCHEMBL16495305 0.74 TNF (0.48) ACHETNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110294850-A1 INDOLINE DERIVATIVES TOKYO INSTITUTE OF TECHNOLOGY (JP) 2011-12-01 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-20110294850-A1 INDOLINE DERIVATIVES BCHE, ACHE, INMT ACHE 2/4885TNF 4863/4885PKM 3699/4885

“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.