SCHEMBL1765100

SCHEMBL1765100

N#Cc1ccc2c(c1)nc1n2C[C@@H](COc2ccc(C3CC3)nc2)O1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
SLC6A2 P23975 4/20 0.34
SLC6A4 P31645 4/20 0.34
CYP11B2 P19099 2/20 0.34
SLC6A3 Q01959 2/20 0.34
CYP11B1 P15538 1/20 0.34
IDH1 O75874 3/20 0.34
S1PR1 P21453 1/20 0.33
HTR3A P46098 1/20 0.33
KCNH2 Q12809 1/20 0.33
MEN1 O00255 1/20 0.32

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
SCHEMBL1512129 0.96 GRM2 (0.36) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1512228 0.87 GRM2 (0.38) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1765157 0.86 GRM2 (0.39) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1511855 0.85 GRM2 (0.40) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1511789 0.85 KDM4E (0.41) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1511698 0.84 KDM4E (0.40) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL2454633 0.84 GRM2 (0.41) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1511916 0.84 GRM2 (0.41) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL12648952 0.84 GRM2 (0.38) GRM2SMN1; SMN2NPSR1KMT2APOLB
SCHEMBL1512028 0.84 SMN1; SMN2 (0.44) GRM2SMN1; SMN2NPSR1KMT2APOLB

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
US-20110124661-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. 2011-05-26 US disclosed
US-20110124661-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. 2011-05-26 US disclosed
US-20110124661-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. 2011-05-26 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-20110124661-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES GRM2, GRM1, GRM3 GRM2 1/4885SMN1; SMN2 1055/4885NPSR1 306/4885

“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.