SCHEMBL4842013

SCHEMBL4842013

CC1CN(C(=O)O)CCN1C(=N)N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 2/20 0.34
CPS1 P31327 1/20 0.33
CPN1 P15169 2/20 0.32
CPB2 Q96IY4 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
PDK1 Q15118 1/20 0.32
PDK2 Q15119 1/20 0.32
PDK3 Q15120 1/20 0.32
PDK4 Q16654 1/20 0.32
GAA P10253 1/20 0.32
GHSR Q92847 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL956460 0.85 TSHR (0.39) TSHRLMNAALOX15HSD17B10L3MBTL1
SCHEMBL17061936 0.83 TSHR (0.41) TSHRLMNAALOX15HSD17B10L3MBTL1
SCHEMBL17061934 0.83 TSHR (0.41) TSHRLMNAALOX15HSD17B10L3MBTL1
SCHEMBL21354258 0.83 TSHR (0.41) TSHRLMNAALOX15HSD17B10L3MBTL1
SCHEMBL4150920 0.81 TSHR (0.41) TSHRLMNAALOX15HSD17B10L3MBTL1
SCHEMBL7995036 0.81 TSHR (0.41) TSHRLMNAALOX15HSD17B10L3MBTL1
SCHEMBL31423844 0.80 GAA (0.47) TSHRL3MBTL1HTTMAPTGAA
SCHEMBL16009932 0.78 TSHR (0.39) TSHRLMNAALOX15HSD17B10L3MBTL1
SCHEMBL28572878 0.78 TSHR (0.39) TSHRLMNAALOX15HSD17B10L3MBTL1
SCHEMBL16010481 0.78 TSHR (0.39) TSHRLMNAALOX15HSD17B10L3MBTL1

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-7439360-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2008-10-21 US disclosed
EP-1802605-A1 IMIDAZOLE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS Amgen, Inc (US) 2007-07-04 EP disclosed
WO-2006044527-A1 IMIDAZOLE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS AMGEN INC. (US) 2006-04-27 WO disclosed
US-20060084640-A1 Vanilloid receptor ligands and their use in treatments AMGEN INC. 2006-04-20 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-20060084640-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV3, TRPV2 TSHR 795/4885LMNA 4246/4885ALOX15 814/4885

“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.