SCHEMBL917328

SCHEMBL917328

O=C(Cl)N1CCN(C2c3ccccc3CCc3ccccc32)CC1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 1/20 0.45
CACNA1G O43497 1/20 0.44
DRD1 P21728 2/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
DRD2 P14416 1/20 0.43
DRD5 P21918 1/20 0.43
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42

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
SCHEMBL31350708 0.78 HPGD (0.60) FNTAFNTB
SCHEMBL3263639 0.78 DRD1 (0.46) DRD1DRD2DRD5FNTAFNTB
SCHEMBL9063252 0.77 NPC1 (0.49) FNTAFNTB
SCHEMBL5267462 0.76 CACNA1G (0.77) CACNA1G
SCHEMBL13503895 0.76 PRCP (0.54) DRD1DRD2DRD5
SCHEMBL7682324 0.76 ALDH1A1 (0.53) NPSR1
SCHEMBL31350745 0.76 FNTA (0.56) FNTAFNTB
SCHEMBL2946237 0.75 DRD1 (0.65) DRD1DRD2DRD5
SCHEMBL14079264 0.75 NOTUM (0.47) NPSR1LMNACACNA1G
SCHEMBL31350903 0.75 FNTA (0.46) FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110071161-A1 TRIAZOLOPYRIDINE CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-03-24 US disclosed
US-7868007-B2 Triazolopyridine carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2011-01-11 US disclosed
US-20100035893-A1 TRIAZOLOPYRIDINE CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-02-11 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 (2 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-20100035893-A1 TRIAZOLOPYRIDINE CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF FLT3, QDPR, CYP1A2 NPSR1 329/4885LMNA 2067/4885CACNA1G 159/4885
US-20110071161-A1 TRIAZOLOPYRIDINE CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF FLT3, QDPR, CYP1A2 NPSR1 329/4885LMNA 2067/4885CACNA1G 159/4885

“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.