SCHEMBL8437435

SCHEMBL8437435

CC(C)NC1(C(N)=O)CCN(C)CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.55
CYP2D6 P10635 1/20 0.55
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 1/20 0.35
NEK2 P51955 1/20 0.30

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
SCHEMBL12258804 0.84 ALDH1A1 (0.51) ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL14364184 0.83 ALDH1A1 (0.39) ALDH1A1CYP2D6KDM4E
SCHEMBL12870586 0.82 ALDH1A1 (0.50) ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL8193648 0.82 ALDH1A1 (0.50) ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL13620545 0.82 ALDH1A1 (0.40) ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL17683026 0.81 CYP2D6 (0.43) ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL8434176 0.81 CYP2D6 (0.62) ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL8253488 0.81 ALDH1A1 (0.51) ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL12869546 0.80 ALDH1A1 (0.49) ALDH1A1CYP2D6KDM4EKMT2A
SCHEMBL15461521 0.80 ALDH1A1 (0.38) ALDH1A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156624-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS INC (US) 2009-06-18 US disclosed
US-7405194-B2 Therapeutic agents and methods of use thereof for the treatment of melanoma PRAECIS PHARMACEUTICALS, INC. (US) 2008-07-29 US disclosed
US-7348307-B2 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS INCORPORATED (US) 2008-03-25 US disclosed
US-7268133-B2 Cannabinoid receptor ligands and uses thereof PFIZER, INC. PATENT DEPARTMENT (US) 2007-09-11 US disclosed
US-20070161570-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS, INC. (US) 2007-07-12 US disclosed
US-20070010452-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof PRAECIS PHARMACEUTICALS, INC. (US) 2007-01-11 US disclosed
US-7157420-B2 Therapeutic agents and methods of use thereof for the modulation of angiogenesis PRAECIS PHARMACEUTICALS, INC. (US) 2007-01-02 US disclosed
US-20040214837-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC. 2004-10-28 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 (4 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-20070010452-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof METAP2, METAP1, DNPEP ALDH1A1 1155/4885CYP2D6 2134/4885KDM4E 1216/4885
US-20040214837-A1 Cannabinoid receptor ligands and uses thereof CNR1, CNR2, GPR18 ALDH1A1 1683/4885CYP2D6 1363/4885KDM4E 3361/4885
US-20070161570-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof METAP2, METAP1, LNPEP ALDH1A1 2278/4885CYP2D6 2876/4885KDM4E 1741/4885
US-20090156624-A1 Methionine aminopeptidase-2 inhibitors and methods of use thereof METAP2, METAP1, DNPEP ALDH1A1 1155/4885CYP2D6 2134/4885KDM4E 1216/4885

“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.