SCHEMBL9201

SCHEMBL9201

CCC(CC1CCCCC1)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.46
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
EPHX1 P07099 2/20 0.42
ALOX5 P09917 2/20 0.40
LTA4H P09960 1/20 0.40
METAP2 P50579 1/20 0.39
REN P00797 1/20 0.37

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
SCHEMBL13518 0.85 ALDH1A1 (0.48) ATMALDH1A1KMT2ACA1CA2
SCHEMBL4990371 0.82 ATM (0.47) ATMALDH1A1KMT2AEPHX1LTA4H
SCHEMBL13711847 0.82 ATM (0.50) ATMALDH1A1KMT2ACA2LTA4H
SCHEMBL2484332 0.82 ATM (0.50) ATMALDH1A1KMT2ACA2LTA4H
SCHEMBL13711848 0.82 ATM (0.50) ATMALDH1A1KMT2ACA2LTA4H
SCHEMBL6189242 0.81 CPN1 (0.53) ATMCA1CA2EPHX1
SCHEMBL5197131 0.81 CA1 (0.48) ALDH1A1KMT2ACA1CA2EPHX1
SCHEMBL13747226 0.80 ATM (0.48) ATMALDH1A1KMT2ACA2LTA4H
SCHEMBL16328249 0.80 ATM (0.44) ATMALDH1A1KMT2ALTA4HMETAP2
SCHEMBL11078577 0.79 ATM (0.45) ATMALDH1A1KMT2AEPHX1LTA4H

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-9296698-B2 Amino heteroaryl compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2016-03-29 US disclosed
US-20120329830-A1 Amino Heteroaryl Compounds as Beta-Secretase Modulators and Methods of Use AMGEN INC. (US) 2012-12-27 US disclosed
EP-2504315-A1 AMINO HETEROARYL COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE Amgen Inc. (US) 2012-10-03 EP disclosed
WO-2011063233-A1 AMINO HETEROARYL COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2011-05-26 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 (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-20120329830-A1 Amino Heteroaryl Compounds as Beta-Secretase Modulators and Methods of Use BACE1, BACE2, APP ATM 3295/4885ALDH1A1 1846/4885KMT2A 1441/4885

“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.