SCHEMBL369387

SCHEMBL369387

Cc1ccnc(Nc2nc(-c3c[nH]nc3-c3ccc(C(O)C(F)(F)F)cc3)cs2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.38
GRM8 O00222 1/20 0.38
NPC1 O15118 13/20 0.36
MEN1 O00255 13/20 0.36
KMT2A Q03164 13/20 0.36
RAB9A P51151 12/20 0.36
SMN1; SMN2 Q16637 7/20 0.36
MAPT P10636 4/20 0.36
TYR P14679 2/20 0.36
NFKB1 P19838 2/20 0.36
NFKB2 Q00653 2/20 0.36
RELA Q04206 2/20 0.36
SENP8 Q96LD8 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
SENP6 Q9GZR1 2/20 0.36
ATM Q13315 1/20 0.36
PKM P14618 1/20 0.36
CYP1A2 P05177 1/20 0.35
THRB P10828 1/20 0.35
POLB P06746 4/20 0.35

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
SCHEMBL370966 0.84 GRM4 (0.45) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL370036 0.84 RAB9A (0.52) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL15166594 0.83 NPC1 (0.46) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL15166605 0.80 GRM4 (0.40) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL12482631 0.79 VCP (0.43) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL15166813 0.79 MEN1 (0.50) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL369836 0.79 MEN1 (0.41) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL369982 0.78 KMT2A (0.49) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL369476 0.77 NPC1 (0.42) GRM4GRM8NPC1MEN1KMT2A
SCHEMBL368784 0.77 NPC1 (0.44) GRM4GRM8NPC1MEN1KMT2A

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-20130210809-A1 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS BOLEA CHRISTELLE (CH) 2013-08-15 US claimed
US-20130210809-A1 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS BOLEA CHRISTELLE (CH) 2013-08-15 US disclosed
EP-2595986-A2 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2013-05-29 EP disclosed
WO-2012009009-A2 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA S.A. (CH) 2012-01-19 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-20130210809-A1 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM2, GRM4, GRM1 GRM4 2/4885GRM8 23/4885NPC1 1289/4885

“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.