SCHEMBL5268467

SCHEMBL5268467

COc1ccc(-n2nc(C(=O)N3CCOCC3)cc2-c2ccn(C)c2)nn1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MGLL Q99685 1/20 0.46
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
HPGD P15428 1/20 0.45
SMPD1 P17405 1/20 0.43
RAB9A P51151 2/20 0.41
NPC1 O15118 2/20 0.41

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
SCHEMBL5270370 0.90 MGLL (0.46) PTGS2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL2918303 0.87 MGLL (0.59) PTGS2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5268500 0.86 PTGS2 (0.48) PTGS2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5269116 0.85 ALOX5 (0.36) PTGS2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5269492 0.85 MEN1 (0.53) PTGS2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5267609 0.84 RPA1 (0.45) MEN1KMT2AMAPTSMN1; SMN2HTT
SCHEMBL5527496 0.81 MALT1 (0.43)
SCHEMBL2919430 0.80 MGLL (0.46) PTGS2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5266917 0.80 PTGS2 (0.43) PTGS2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5273014 0.80 PTGS2 (0.43) PTGS2MEN1KMT2AMAPTSMN1; SMN2

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 5 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
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 PTGS2 4/4885MEN1 3587/4885KMT2A 3446/4885

“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.