SCHEMBL3668668

SCHEMBL3668668

C[N+](C)(C#N)CC(I)CC(=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC22A16 Q86VW1 1/20 0.42
CPT2 P23786 1/20 0.40
CPT1A P50416 1/20 0.40
CRAT P43155 1/20 0.40
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
HRH1 P35367 1/20 0.36
CA2 P00918 1/20 0.34
CYP2C19 P33261 1/20 0.34
RECQL P46063 1/20 0.34
CA4 P22748 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
Water SCHEMBL3680487 0.79 SLC22A16 (0.64) SLC22A16CPT2CPT1ACRATMEN1
SCHEMBL3668709 0.79 SLC22A16 (0.64) SLC22A16CPT2CPT1ACRATMEN1
Hydrochloric Acid SCHEMBL3675692 0.78 SLC22A16 (0.62) SLC22A16CPT2CPT1ACRATMEN1
SCHEMBL3669963 0.78 SLC22A16 (0.42) SLC22A16CPT2CPT1ACRATMEN1
SCHEMBL6664365 0.78 SLC22A16 (0.42) SLC22A16CPT2CPT1ACRATMEN1
Sulfuric Acid SCHEMBL3672616 0.74 SLC22A16 (0.56) SLC22A16CPT2CPT1ACRATMEN1
SCHEMBL3677887 0.73 MEN1 (0.68) SLC22A16CPT2CPT1ACRATMEN1
SCHEMBL3676901 0.70 MEN1 (0.41) SLC22A16CPT2CPT1ACRATMEN1
Carnitine SCHEMBL27673497 0.67 SLC22A16 (0.83) SLC22A16CPT2CPT1ACRATMEN1
Carnitine SCHEMBL31299810 0.64 SLC22A16 (0.77) SLC22A16CPT2CPT1ACRATMEN1

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-7714166-B2 Process for producing carnitinamide MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-05-11 US disclosed
US-20090143616-A1 Process for Producing Carnitinamide MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2009-06-04 US disclosed
CN-101304965-A Process for producing carnitinamide MITSUBISHI GAS CHEMICAL CO (JP) 2008-11-12 CN disclosed
EP-1930314-A1 PROCESS FOR PRODUCING CARNITINAMIDE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2008-06-11 EP 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-20090143616-A1 Process for Producing Carnitinamide CRAT, NISCH, NAAA SLC22A16 904/4885CPT2 5/4885CPT1A 7/4885

“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.