SCHEMBL2546279

SCHEMBL2546279

Cn1nc(C(=O)Nc2cccc(Cl)c2)c2c1-c1cc(F)ccc1OC2

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.55
▸ POLB P06746 3/20 0.55
▸ NR1H4 Q96RI1 7/20 0.50
▸ TP53 P04637 2/20 0.50
▸ THRB P10828 1/20 0.50
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MAOA P21397 1/20 0.45
▸ MAOB P27338 1/20 0.45
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43

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
SCHEMBL2173312 0.92 MAPT (0.61) MAPTPOLBNR1H4TP53THRB
SCHEMBL2547296 0.89 MAPT (0.69) MAPTPOLBNR1H4TP53THRB
SCHEMBL2174844 0.85 RAB9A (0.47) MAPTPOLBNR1H4TP53THRB
SCHEMBL2172534 0.80 MAPT (0.68) MAPTPOLBNR1H4TP53THRB
SCHEMBL2547306 0.79 MAPT (0.79) MAPTPOLBNR1H4TP53THRB
SCHEMBL2173369 0.79 NR1H4 (0.53) MAPTPOLBNR1H4THRB
SCHEMBL22299813 0.78 MAPT (0.54) MAPTPOLBNR1H4TP53KDM4E
SCHEMBL2171108 0.77 MAPT (0.79) MAPTPOLBNR1H4TP53THRB
SCHEMBL2542966 0.77 MAPT (0.70) MAPTPOLBTP53THRBMEN1
SCHEMBL2542223 0.77 MAPT (0.66) MAPTPOLBTP53MEN1KMT2A

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
US-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 — — US claimed
US-11033545-B2 Negative allosteric modulators of MGLUR5 for use in the treatment of mature brain damages Sinntaxis AB (SE) 2021-06-15 — — US disclosed
US-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 — — US disclosed
US-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 — — US disclosed
US-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2011-10-27 — — US disclosed
WO-2010049366-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2010-05-06 — — 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-20110263588-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GRM5, GRM1, GRM3 MAPT 2044/4885POLB 4360/4885NR1H4 294/4885
US-11033545-B2 Negative allosteric modulators of MGLUR5 for use in the treatment of mature brain damages GRM5, GRIK5, GRM1 MAPT 1070/4885POLB 3275/4885NR1H4 1022/4885

“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.

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