SCHEMBL3453112

SCHEMBL3453112

NC(=S)NN1CCCCC1N1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
KMT2A Q03164 2/20 0.34
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.30
L3MBTL3 Q96JM7 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
SCHEMBL7354829 0.67 KMT2A (0.47) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL3452601 0.66 CA12 (0.61) MAPTALDH1A1KDM4EKMT2ACA12
SCHEMBL29360628 0.64 ALDH1A1 (0.39) MAPTALDH1A1NPSR1KDM4EMCOLN3
SCHEMBL28228185 0.61 MEN1 (0.38) MAPTALDH1A1NPSR1KDM4EMCOLN3
SCHEMBL2461404 0.61 SMN1; SMN2 (0.33) MAPTALDH1A1NPSR1KDM4EMCOLN3
SCHEMBL28177984 0.59 ALDH1A1 (0.31) ALDH1A1
SCHEMBL7124293 0.59 SMN1; SMN2 (0.33) MAPTALDH1A1NPSR1KDM4EMCOLN3
SCHEMBL30722257 0.59 SMN1; SMN2 (0.33) MAPTALDH1A1NPSR1KDM4EMCOLN3
SCHEMBL1837999 0.59 L3MBTL3 (0.47) MAPTALDH1A1NPSR1KDM4EMCOLN3
SCHEMBL1827648 0.58 SMN1; SMN2 (0.54) ALDH1A1KDM4EL3MBTL1L3MBTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060142285-A1 Pharmaceutical composition comprising N-aryl N' morpholino/piperidino thiocarbamide derivatives for treating and preventing diabetes, diabetic complications, insulin resistance and insulin resistance syndrome KIM SUNG-JIN 2006-06-29 US claimed
US-7820656-B2 Pharmaceutical composition comprising N-aryl N′ morpholino/piperidino thiocarbamide derivatives for treating type II diabetes Kim, Sung-jin (KR) 2010-10-26 US disclosed
US-7820656-B2 Pharmaceutical composition comprising N-aryl N′ morpholino/piperidino thiocarbamide derivatives for treating type II diabetes Kim, Sung-jin (KR) 2010-10-26 US disclosed
US-7820656-B2 Pharmaceutical composition comprising N-aryl N′ morpholino/piperidino thiocarbamide derivatives for treating type II diabetes Kim, Sung-jin (KR) 2010-10-26 US disclosed
US-20060142285-A1 Pharmaceutical composition comprising N-aryl N' morpholino/piperidino thiocarbamide derivatives for treating and preventing diabetes, diabetic complications, insulin resistance and insulin resistance syndrome KIM SUNG-JIN 2006-06-29 US disclosed
US-20060142285-A1 Pharmaceutical composition comprising N-aryl N' morpholino/piperidino thiocarbamide derivatives for treating and preventing diabetes, diabetic complications, insulin resistance and insulin resistance syndrome KIM SUNG-JIN 2006-06-29 US disclosed
US-20060142285-A1 Pharmaceutical composition comprising N-aryl N' morpholino/piperidino thiocarbamide derivatives for treating and preventing diabetes, diabetic complications, insulin resistance and insulin resistance syndrome KIM SUNG-JIN 2006-06-29 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 (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-20060142285-A1 Pharmaceutical composition comprising N-aryl N' morpholino/piperidino thiocarbamide derivatives for treating and preventing diabetes, diabetic complications, insulin resistance and insulin resistance syndrome GPR119, INSR, MTPN MAPT 4321/4885ALDH1A1 2865/4885NPSR1 1943/4885

“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.