SCHEMBL3639173

SCHEMBL3639173

CN(C)c1cccc(NC(=O)c2cccnc2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 1/20 0.68
▸ BRAF P15056 1/20 0.68
▸ CSF1R P07333 1/20 0.67
▸ TSHR P16473 2/20 0.64
▸ HTT P42858 2/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.64
▸ LMNA P02545 1/20 0.64
▸ HIF1A Q16665 1/20 0.64
▸ HDAC1 Q13547 1/20 0.64
▸ KMT2A Q03164 4/20 0.62
▸ MEN1 O00255 3/20 0.62
▸ RAB9A P51151 3/20 0.61
▸ TDP1 Q9NUW8 1/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ CYP2C9 P11712 1/20 0.60
▸ ATR Q13535 1/20 0.59
▸ MAPT P10636 1/20 0.59
▸ GFER P55789 1/20 0.59
▸ NPSR1 Q6W5P4 1/20 0.59
▸ ROCK2 O75116 1/20 0.58

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
SCHEMBL14082538 0.86 ATR (0.62) KCNK3BRAFCSF1RLMNAHDAC1
SCHEMBL3637857 0.85 NPSR1 (0.75) SMN1; SMN2LMNAHIF1AHDAC1KMT2A
SCHEMBL7745692 0.83 KCNK3 (0.80) KCNK3SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL259177 0.82 TDP1 (0.78) KCNK3BRAFCSF1RTSHRHTT
SCHEMBL3934184 0.81 BRAF (1.00) BRAFCSF1R
SCHEMBL3931681 0.81 BRAF (0.79) BRAFCSF1R
SCHEMBL3934788 0.81 CSF1R (1.00) BRAFCSF1R
SCHEMBL12411966 0.80 GRM5 (0.66) KCNK3BRAFCSF1RLMNAKMT2A
SCHEMBL10940026 0.80 KCNK3 (0.81) KCNK3TSHRHTTSMN1; SMN2LMNA
SCHEMBL1520222 0.80 KCNK3 (0.76) KCNK3TSHRHTTSMN1; SMN2LMNA

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-9242933-B2 Heterocyclic compounds as positive modulators of metabotropic glutamate receptor 2 (mGlu2 receptor) AbbVie Deutschland GmbH & Co. KG (DE) 2016-01-26 — — US disclosed
EP-2167464-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) Abbott GmbH & Co. KG (DE) 2010-03-31 — — EP disclosed
WO-2008145616-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 RECEPTOR) ABBOTT GMBH & CO. KG (DE) 2008-12-04 — — WO disclosed
US-20080300260-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 receptor) ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2008-12-04 — — 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-20080300260-A1 HETEROCYCLIC COMPOUNDS AS POSITIVE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 (MGLU2 receptor) GRM2, GRIN2C, GRM1 KCNK3 1223/4885BRAF 4607/4885CSF1R 1747/4885

“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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