SCHEMBL3685494

SCHEMBL3685494

CCCCCCCCCCCCCCN(C)C(=O)N[C@H](CC(=O)[O-])C[N+](C)(C)C

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 3/20 0.64
CPT1A P50416 3/20 0.64
CPT1B Q92523 3/20 0.64
CRAT P43155 1/20 0.52

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
SCHEMBL3685495 1.00 CPT2 (0.64) CPT2CPT1ACPT1BCRAT
SCHEMBL13409955 0.88 CPT2 (0.48) CPT2CPT1ACPT1B
SCHEMBL3688614 0.85 CPT2 (0.70) CPT2CPT1ACPT1B
SCHEMBL3688617 0.85 CPT2 (0.70) CPT2CPT1ACPT1B
SCHEMBL3680152 0.79 CPT2 (0.54) CPT2CPT1ACPT1B
SCHEMBL3680156 0.79 CPT2 (0.54) CPT2CPT1ACPT1B
Palmitoylaminocarnitine SCHEMBL10414832 0.78 CPT2 (1.00) CPT2CPT1ACPT1BCRAT
SCHEMBL10415639 0.78 CPT2 (1.00) CPT2CPT1ACPT1BCRAT
Palmitoylaminocarnitine SCHEMBL10414831 0.78 CPT2 (1.00) CPT2CPT1ACPT1BCRAT
SCHEMBL10415637 0.78 CPT2 (1.00) CPT2CPT1ACPT1BCRAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8410150-B2 Inhibitors of carnitine palmitoyltransferase and treating cancer UNIVERSITY HEALTH NETWORK (CA) 2013-04-02 US disclosed
US-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK 2010-04-29 US disclosed
WO-2008109991-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK (CA) 2008-09-18 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-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER CPT1A, CPT1B, CPT2 CPT2 3/4885CPT1A 1/4885CPT1B 2/4885

“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.