SCHEMBL5712398

SCHEMBL5712398

CC(=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 9)

geneUniProtsupporting neighboursconfidence
▸ CRAT P43155 1/20 1.00
▸ CPT2 P23786 3/20 0.58
▸ CPT1A P50416 3/20 0.58
▸ CPT1B Q92523 2/20 0.58
▸ SLC22A16 Q86VW1 1/20 0.53
▸ MEN1 O00255 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ HRH1 P35367 1/20 0.49
▸ KMT2A Q03164 1/20 0.49

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
SCHEMBL5712374 1.00 CRAT (1.00) CRATCPT2CPT1ACPT1BSLC22A16
SCHEMBL4339313 1.00 CRAT (1.00) CRATCPT2CPT1ACPT1BSLC22A16
Hydrochloric Acid SCHEMBL10415561 0.81 CRAT (0.68) CRATCPT2CPT1ACPT1BMEN1
Hydrochloric Acid SCHEMBL10415560 0.81 CRAT (0.68) CRATCPT2CPT1ACPT1BMEN1
Hydrochloric Acid SCHEMBL10415559 0.81 CRAT (0.68) CRATCPT2CPT1ACPT1BMEN1
SCHEMBL24634587 0.79 CPT2 (0.69) CRATCPT2CPT1ACPT1BSLC22A16
SCHEMBL14070123 0.78 CRAT (0.63) CRATCPT2CPT1ACPT1BSLC22A16
SCHEMBL24634589 0.78 CRAT (0.63) CRATCPT2CPT1ACPT1BSLC22A16
SCHEMBL24634585 0.76 CRAT (0.61) CRATCPT2CPT1ACPT1BSLC22A16
SCHEMBL3679268 0.75 CRAT (0.58) CRATCPT2CPT1ACPT1BMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1409448-B1 PROCESS FOR THE PREPARATION OF (R)- OR (S)-AMINOCARNITINE INNER SALT, THE SALTS AND DERIVATIVES THEREOF SIGMA TAU IND FARMACEUTI (IT) 2006-11-29 — — EP disclosed
US-6953865-B2 Process for the preparation of (r)- or (s)-aminocarnitine inner salt, the salts and derivatives thereof SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2005-10-11 — — US disclosed
US-20040171875-A1 Process for the preparation of (r)- or (s)-aminocarnitine inner salt, the salts and derivatives thereof SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2004-09-02 — — US disclosed
EP-1409448-A1 PROCESS FOR THE PREPARATION OF (R)- OR (S)-AMINOCARNITINE INNER SALT, THE SALTS AND DERIVATIVES THEREOF Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 2004-04-21 — — EP disclosed
WO-2003010129-A1 PROCESS FOR THE PREPARATION OF (R)- OR (S)-AMINOCARNITINE INNER SALT, THE SALTS AND DERIVATIVES THEREOF SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2003-02-06 — — WO disclosed
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