SCHEMBL2920291

SCHEMBL2920291

Cc1cccc(-c2cc([C@H](C)N(C)c3nnc(-c4cn[nH]c(=O)c4)n3C)no2)c1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 8/20 0.68
NPSR1 Q6W5P4 1/20 0.32
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.30
CSF1R P07333 1/20 0.30
NOTUM Q6P988 1/20 0.30
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30
MAPK14 Q16539 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
SCHEMBL2921700 0.87 GRM5 (0.57) GRM5NPSR1MAPTLMNAKMT2A
SCHEMBL4089323 0.85 GRM5 (0.49) GRM5MAPTLMNAKMT2A
SCHEMBL4089356 0.83 GRM5 (0.56) GRM5MAPTLMNAKMT2AMAPK14
SCHEMBL3121588 0.81 GRM5 (0.69) GRM5NPSR1MAPTLMNAKMT2A
SCHEMBL3121575 0.81 GRM5 (0.69) GRM5NPSR1MAPTLMNAKMT2A
SCHEMBL2959176 0.81 GRM5 (1.00) GRM5NPSR1MAPTKMT2ACSF1R
SCHEMBL4097309 0.79 GRM5 (0.64) GRM5MAPTCSF1R
SCHEMBL2916685 0.79 GRM5 (0.57) GRM5NPSR1MAPTLMNAMAPK14
SCHEMBL2917638 0.75 GRM5 (0.68) GRM5
SCHEMBL4193512 0.74 GRM5 (0.60) GRM5MAPT

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-2212316-A1 AMINO 1,2,4-TRIAZOLE DERIVATIVES AS MODULATORS OF MGLUR5 AstraZeneca AB (SE) 2010-08-04 EP claimed
US-20090111821-A1 AMINO 1,2,4-TRIAZOLE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 US claimed
WO-2009054794-A1 AMINO 1,2,4-TRIAZOLE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 WO claimed
US-20090111821-A1 AMINO 1,2,4-TRIAZOLE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 US disclosed
US-20090111821-A1 AMINO 1,2,4-TRIAZOLE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 US disclosed
US-20090111821-A1 AMINO 1,2,4-TRIAZOLE DERIVATIVES AS MODULATORS OF MGLUR5 ASTRAZENECA AB (SE) 2009-04-30 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-20090111821-A1 AMINO 1,2,4-TRIAZOLE DERIVATIVES AS MODULATORS OF MGLUR5 GRM5, GRIK5, GRM1 GRM5 1/4885NPSR1 369/4885MAPT 635/4885

“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.