SCHEMBL2913544

SCHEMBL2913544

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 3/20 0.61
CPT1A P50416 3/20 0.61
CPT1B Q92523 3/20 0.61

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
SCHEMBL27260035 0.83 CRAT (0.53) CPT2CPT1ACPT1B
SCHEMBL2908109 0.81 CPT2 (0.59) CPT2CPT1ACPT1B
SCHEMBL3692201 0.77 CPT2 (0.54) CPT2CPT1ACPT1B
SCHEMBL3684464 0.76 CA12 (0.47) CPT2CPT1ACPT1B
SCHEMBL3682503 0.76 CA12 (0.47) CPT2CPT1ACPT1B
SCHEMBL3686202 0.76 CA12 (0.47) CPT2CPT1ACPT1B
SCHEMBL3677874 0.76 CA12 (0.47) CPT2CPT1ACPT1B
SCHEMBL3677878 0.76 CA12 (0.47) CPT2CPT1ACPT1B
SCHEMBL3687140 0.76 CA12 (0.47) CPT2CPT1ACPT1B
SCHEMBL3682504 0.76 CA12 (0.47) CPT2CPT1ACPT1B

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8314144-B2 Compounds having antitumor activity DEFIANTE FARMACEUTICA, S.A. (PT) 2012-11-20 US claimed
US-20100227791-A1 Compounds Having Antitumor Activity DEFIANTE FARMACEUTICA, S.A. (PT) 2010-09-09 US claimed
EP-1713461-B1 COMPOUNDS HAVING ANTITUMOR ACTIVITY DEFIANTE FARMACEUTICA SA (PT) 2010-08-11 EP claimed
EP-1484313-B1 Compounds having reversible inhibiting activity of carnitine palmitoyl-transferase SIGMA TAU IND FARMACEUTI (IT) 2010-04-28 EP claimed
US-RE40861-E1 Compounds having reversible inhibiting activity of carnitine palmitoyl-transferase Sigma-Tau Industrie Farmaceutiche Reunite S.p.A. (IT) 2009-07-21 US claimed
US-20080227683-A1 Compounds Having Antitumor Activity DEFIANTE FARMACEUTICA LDA (PT) 2008-09-18 US claimed
EP-1713461-A1 COMPOUNDS HAVING ANTITUMOR ACTIVITY DEFIANTE FARMACEUTICA LDA. (PT) 2006-10-25 EP claimed
WO-2005077354-A1 COMPOUNDS HAVING ANTITUMOR ACTIVITY DEFIANTE FARMACEUTICA LDA. (PT) 2005-08-25 WO claimed
JP-2003513002-A 2003-04-08 JP claimed
WO-1999059957-A9 COMPOUNDS HAVING REVERSIBLE INHIBITING ACTIVITY OF CARNITINE PALMITOYL-TRANSFERASE SIGMA TAU IND FARMACEUTI (IT) 2002-06-13 WO claimed
US-20020052348-A1 Compounds having reversible inhibiting activity of carnitine palmitoyl-transferase SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. 2002-05-02 US claimed
US-6369073-B1 HYPERGLYCEMIA, DIABETES, HEART FAILURE, ISCHEMIA SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2002-04-09 US claimed
EP-1077925-A1 COMPOUNDS HAVING REVERSIBLE INHIBITING ACTIVITY OF CARNITINE PALMITOYL-TRANSFERASE Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 2001-02-28 EP claimed
WO-1999059957-A1 COMPOUNDS HAVING REVERSIBLE INHIBITING ACTIVITY OF CARNITINE PALMITOYL-TRANSFERASE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 1999-11-25 WO claimed
US-8314144-B2 Compounds having antitumor activity DEFIANTE FARMACEUTICA, S.A. (PT) 2012-11-20 US disclosed
US-20100227791-A1 Compounds Having Antitumor Activity DEFIANTE FARMACEUTICA, S.A. (PT) 2010-09-09 US disclosed
US-20100210695-A1 COMPOSITIONS AND METHODS FOR TREATING SKIN DISORDERS DARA BIOSCIENCES, INC. (US) 2010-08-19 US disclosed
US-6369073-B1 HYPERGLYCEMIA, DIABETES, HEART FAILURE, ISCHEMIA SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2002-04-09 US disclosed
EP-1077925-A1 COMPOUNDS HAVING REVERSIBLE INHIBITING ACTIVITY OF CARNITINE PALMITOYL-TRANSFERASE Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 2001-02-28 EP disclosed
WO-1999059957-A1 COMPOUNDS HAVING REVERSIBLE INHIBITING ACTIVITY OF CARNITINE PALMITOYL-TRANSFERASE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 1999-11-25 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 (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-20020052348-A1 Compounds having reversible inhibiting activity of carnitine palmitoyl-transferase CPT1A, CPT1B, CPT2 CPT2 3/4885CPT1A 1/4885CPT1B 2/4885
US-20080227683-A1 Compounds Having Antitumor Activity GZMB, XPA, MKI67 CPT2 1584/4885CPT1A 280/4885CPT1B 2051/4885
US-20100210695-A1 COMPOSITIONS AND METHODS FOR TREATING SKIN DISORDERS CPT1B, CPT1A, CPT2 CPT2 3/4885CPT1A 2/4885CPT1B 1/4885
US-20100227791-A1 Compounds Having Antitumor Activity GZMB, XPA, MKI67 CPT2 1584/4885CPT1A 280/4885CPT1B 2051/4885

“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.