SCHEMBL4281633

SCHEMBL4281633

CCOC(=O)CCNC(=O)c1n[nH]cc1NC(=O)c1cccc(C)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.43
P2RX7 Q99572 1/20 0.41
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
TOP2A P11388 1/20 0.37
CHRNA7 P36544 2/20 0.36
CHRNA10 Q9GZZ6 2/20 0.36
CHRNA9 Q9UGM1 2/20 0.36
KIFC1 Q9BW19 2/20 0.36
MAPK8 P45983 1/20 0.36
MAPK10 P53779 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CYP1A2 P05177 1/20 0.35
PTPN7 P35236 1/20 0.35
ALDH1A1 P00352 1/20 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
SCHEMBL4288450 0.90 GRM5 (0.44) GRM5P2RX7KMT2AMEN1CHRNA7
SCHEMBL4288777 0.89 GRM5 (0.45) GRM5P2RX7KMT2AMEN1MAPK8
SCHEMBL4283563 0.86 GRM5 (0.47) GRM5P2RX7KMT2AMEN1MAPK8
SCHEMBL4279992 0.85 GRM5 (0.46) GRM5P2RX7KMT2AMEN1CHRNA7
SCHEMBL4287245 0.84 GRM5 (0.45) GRM5P2RX7KMT2AMEN1MAPK8
SCHEMBL4285745 0.82 GRM5 (0.43) GRM5P2RX7KMT2AMEN1MAPT
SCHEMBL4285811 0.82 GRM5 (0.43) GRM5P2RX7KMT2AMEN1CHRNA7
SCHEMBL4281267 0.81 SMN1; SMN2 (0.57) KMT2AMEN1LMNAMAPTNPC1
SCHEMBL4292302 0.81 GSK3B (0.47) GRM5P2RX7KMT2AMEN1LMNA
SCHEMBL4288595 0.80 GRM5 (0.45) GRM5P2RX7KMT2AMEN1MAPK8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156582-A1 Pyrazole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
EP-1847531-A1 PYRAZOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-10-24 EP 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-20090156582-A1 Pyrazole Compound GSK3B, GSK3A, GSKIP GRM5 3842/4885P2RX7 1137/4885KMT2A 871/4885

“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.