SCHEMBL7897356

SCHEMBL7897356

C#Cc1cc(C)nc(C(=O)Nc2ccn(C)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.51
NPC1 O15118 6/20 0.50
RAB9A P51151 5/20 0.50
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 1/20 0.42
HPGDS O60760 1/20 0.41
MAPK7 Q13164 1/20 0.40
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL7904711 0.88 GRM5 (0.51) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL7905661 0.82 NPC1 (0.59) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1796312 0.82 GRM5 (0.55) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1795083 0.81 GRM5 (0.54) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1792287 0.78 NPC1 (0.54) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL13148025 0.78 GRM5 (0.51) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1797965 0.77 GRM5 (0.51) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1796683 0.77 GRM5 (0.47) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1796214 0.76 GRM5 (0.49) GRM5NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1794034 0.76 GRM5 (0.49) GRM5NPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010100050-A1 PYRIDINE-2-YL-CARBOXYLIC ACID AMIDES F. HOFFMANN-LA ROCHE AG (CH) 2010-09-10 WO disclosed
US-20100227887-A1 PYRIDINE-2-YL CARBOXYLIC ACID AMIDES F. HOFFMANN-LA ROCHE AG (CH) 2010-09-09 US disclosed
US-20100227887-A1 PYRIDINE-2-YL CARBOXYLIC ACID AMIDES F. HOFFMANN-LA ROCHE AG (CH) 2010-09-09 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-20100227887-A1 PYRIDINE-2-YL CARBOXYLIC ACID AMIDES GRM2, GRM1, GRM3 GRM5 6/4885NPC1 4161/4885RAB9A 2626/4885

“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.