SCHEMBL2010681

SCHEMBL2010681

Cc1ccc(C(NC(=O)CN)c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.69
SLC6A9 P48067 3/20 0.56
TSHR P16473 1/20 0.55
KMT2A Q03164 5/20 0.54
MEN1 O00255 3/20 0.54
CNR1 P21554 2/20 0.51
CNR2 P34972 2/20 0.51
ALDH1A1 P00352 4/20 0.50
GAA P10253 1/20 0.50
MDM4 O15151 1/20 0.49
MAPT P10636 1/20 0.49
MDM2 Q00987 1/20 0.49
HPGD P15428 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
SLC6A5 Q9Y345 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
Hydrochloric Acid SCHEMBL2008550 0.98 LMNA (0.67) LMNASLC6A9TSHRKMT2AMEN1
SCHEMBL4184595 0.90 TSHR (0.61) LMNASLC6A9TSHRKMT2AMEN1
SCHEMBL4001999 0.84 SLC6A9 (0.63) LMNASLC6A9TSHRKMT2AMEN1
Hydrochloric Acid SCHEMBL2010289 0.83 SLC6A9 (0.62) LMNASLC6A9TSHRKMT2AMEN1
SCHEMBL22408310 0.81 LMNA (1.00) LMNASLC6A9TSHRKMT2AMEN1
SCHEMBL28166494 0.81 LMNA (0.60) LMNASLC6A9TSHRKMT2AMEN1
SCHEMBL8212646 0.80 KDM4E (0.57) SLC6A9TSHRKMT2AMEN1CNR2
Hydrochloric Acid SCHEMBL28055613 0.80 LMNA (0.97) LMNASLC6A9TSHRKMT2AMEN1
SCHEMBL14409534 0.80 LMNA (0.72) LMNASLC6A9TSHRKMT2AMEN1
SCHEMBL31249626 0.79 NPSR1 (0.62) LMNASLC6A9TSHRKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964645-B2 Glycine transporter gene 1 (GlyT-1); psychosis, schizophrenia, dementia; activation of NMDA receptors via GlyT-1 inhibition; N-(([(4-chloro-phenyl)-phenyl-methyl]-carbamoyl)-methyl)-4-fluorobenzamide for example HOFFMANN-LA ROCHE INC. (US) 2011-06-21 US disclosed
US-7964645-B2 Glycine transporter gene 1 (GlyT-1); psychosis, schizophrenia, dementia; activation of NMDA receptors via GlyT-1 inhibition; N-(([(4-chloro-phenyl)-phenyl-methyl]-carbamoyl)-methyl)-4-fluorobenzamide for example HOFFMANN-LA ROCHE INC. (US) 2011-06-21 US disclosed
US-7964645-B2 Glycine transporter gene 1 (GlyT-1); psychosis, schizophrenia, dementia; activation of NMDA receptors via GlyT-1 inhibition; N-(([(4-chloro-phenyl)-phenyl-methyl]-carbamoyl)-methyl)-4-fluorobenzamide for example HOFFMANN-LA ROCHE INC. (US) 2011-06-21 US disclosed
EP-2066620-A1 DI-AROMATIC SUBSTITUTED AMIDES AS INHIBITORS FOR GLYT1 F. Hoffmann-Roche AG (CH) 2009-06-10 EP disclosed
US-20080076806-A1 Di-aromatic substituted amides as inhibitors for GlyT-1 F. HOFFMANN-LA ROCHE AG (CH) 2008-03-27 US disclosed
US-20080076806-A1 Di-aromatic substituted amides as inhibitors for GlyT-1 F. HOFFMANN-LA ROCHE AG (CH) 2008-03-27 US disclosed
US-20080076806-A1 Di-aromatic substituted amides as inhibitors for GlyT-1 F. HOFFMANN-LA ROCHE AG (CH) 2008-03-27 US disclosed
WO-2008022938-A1 DI-AROMATIC SUBSTITUTED AMIDES AS INHIBITORS FOR GLYT1 F. HOFFMANN-LA ROCHE AG (CH) 2008-02-28 WO disclosed
WO-2008022938-A1 DI-AROMATIC SUBSTITUTED AMIDES AS INHIBITORS FOR GLYT1 F. HOFFMANN-LA ROCHE AG (CH) 2008-02-28 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 (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-20080076806-A1 Di-aromatic substituted amides as inhibitors for GlyT-1 AGXT, SLC1A2, GRIA1 LMNA 3382/4885SLC6A9 43/4885TSHR 1689/4885

“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.