SCHEMBL5266953

SCHEMBL5266953

COc1ccc(-n2nc(C(=O)N3CCOCC3)cc2-c2ccc(C#N)cn2)nn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 3/20 0.43
MKNK2 Q9HBH9 3/20 0.43
PTGS2 P35354 4/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 3/20 0.40
KDM1A O60341 2/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MGLL Q99685 1/20 0.39
GRM5 P41594 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
HPGD P15428 1/20 0.38
EIF4E P06730 1/20 0.38
IRAK4 Q9NWZ3 2/20 0.38
AURKA O14965 1/20 0.38
KIT P10721 1/20 0.38

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
SCHEMBL5268748 0.88 PTGS2 (0.44) PTGS2MEN1KMT2AMAPTRAB9A
SCHEMBL5269210 0.86 PTGS2 (0.41) PTGS2MEN1KMT2AMAPTRAB9A
SCHEMBL5266917 0.85 PTGS2 (0.43) PTGS2MEN1KMT2AMAPTRAB9A
SCHEMBL5269685 0.85 PTGS2 (0.41) PTGS2MEN1KMT2AMAPTRAB9A
SCHEMBL5274316 0.85 PTGS2 (0.42) PTGS2MEN1KMT2AMAPTRAB9A
SCHEMBL5271831 0.84 RPA1 (0.43)
SCHEMBL2919430 0.84 MGLL (0.46) PTGS2MEN1KMT2AMAPTRAB9A
SCHEMBL5268935 0.83 EGLN2 (0.39)
SCHEMBL5274536 0.81 PTGS2 (0.43) PTGS2MEN1KMT2AMAPTRAB9A
SCHEMBL2914634 0.81 PTGS2 (0.43) PTGS2MEN1KMT2AMAPTRAB9A

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-20070254881-A1 Pyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
US-20070254881-A1 Pyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
EP-1785418-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 EP disclosed
EP-1785418-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 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-20070254881-A1 Pyrazole Derivative PTGER1, PTGS1, PTGER2 MKNK1 1966/4885MKNK2 1189/4885PTGS2 4/4885

“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.