SCHEMBL2893146

SCHEMBL2893146

CCn1c(-c2ccncc2)n[nH]c1=S

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.77
LMNA P02545 2/20 0.70
APOBEC3G Q9HC16 6/20 0.69
KDM4E B2RXH2 3/20 0.69
KMT2A Q03164 2/20 0.69
GFER P55789 1/20 0.69
MEN1 O00255 1/20 0.69
TSHR P16473 1/20 0.69
CYP1A2 P05177 1/20 0.68
CYP2C19 P33261 1/20 0.68
ALDH1A1 P00352 8/20 0.68
HSD17B10 Q99714 3/20 0.68
HPGD P15428 1/20 0.68
HTT P42858 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
POLB P06746 3/20 0.66
BCHE P06276 1/20 0.58
GAA P10253 1/20 0.58
MAPT P10636 1/20 0.57

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
SCHEMBL8978645 0.85 KDM4E (0.71) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL1544025 0.83 TDP1 (0.68) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL8978573 0.82 KDM4E (0.72) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL1545255 0.82 KDM4E (0.72) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL8978563 0.82 APOBEC3G (1.00) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL8978649 0.81 ALDH1A1 (0.78) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL8978559 0.81 GFER (0.74) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL8978685 0.81 ALDH1A1 (1.00) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL1545252 0.80 TDP1 (0.68) TDP1LMNAAPOBEC3GKDM4EKMT2A
SCHEMBL1544475 0.77 HSD17B10 (0.71) TDP1LMNAAPOBEC3GKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1716125-B1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS ASTRAZENECA AB (SE) 2013-06-19 EP disclosed
US-7691892-B2 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2010-04-06 US disclosed
US-20070197549-A1 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-08-23 US disclosed
EP-1716125-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS AstraZeneca AB (SE) 2006-11-02 EP disclosed
US-20060004021-A1 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB 2006-01-05 US disclosed
WO-2005080356-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS ASTRAZENECA AB (SE) 2005-09-01 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 (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-20060004021-A1 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists GRM1, GRM3, GRM4 TDP1 3600/4885LMNA 4488/4885APOBEC3G 4774/4885
US-20070197549-A1 Tetrazole compounds and their use as metabotropic glutamate receptor antagonists GRM1, GRM3, GRM4 TDP1 3619/4885LMNA 4515/4885APOBEC3G 4789/4885

“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.