SCHEMBL4923151

SCHEMBL4923151

O=C(c1cc(-c2ccc(OCc3ccccc3)cn2)n(-c2cccnc2)n1)N1CCC(F)(F)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 2/20 0.45
CYP4F2 P78329 4/20 0.43
CYP4A11 Q02928 4/20 0.43
MGLL Q99685 9/20 0.42
BCL2 P10415 1/20 0.41
MCL1 Q07820 1/20 0.41
SLC6A7 Q99884 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP2D6 P10635 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
SCHEMBL4931335 0.88 MGLL (0.38) CYP4F2CYP4A11MGLL
SCHEMBL4935720 0.88 HPGD (0.45) MGLLALDH1A1CYP2D6
SCHEMBL4932632 0.85 CHRNA7 (0.38) MGLL
SCHEMBL4931192 0.85 MGLL (0.45) MGLL
SCHEMBL4924280 0.85 MGLL (0.38) MGLLALDH1A1
SCHEMBL4926813 0.85 VNN1 (0.39) MGLLALDH1A1CYP2D6
SCHEMBL4932048 0.85 MGLL (0.38) MGLLALDH1A1CYP2D6
SCHEMBL4923110 0.84 MDM2 (0.62) MDM2CYP4F2CYP4A11BCL2MCL1
SCHEMBL4931012 0.84 CHRNA7 (0.39) MGLLALDH1A1CYP2D6
SCHEMBL4936031 0.84 MGLL (0.38) MGLLCYP2D6

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-20080064682-A1 Pyrazole Derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-13 US disclosed
CN-1980912-A Pyrazole derivatives DAIICHI SEIYAKU CO (JP) 2007-06-13 CN disclosed
EP-1762568-A1 PYRAZOLE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-03-14 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-20080064682-A1 Pyrazole Derivatives NAT1, AR, CBR3 MDM2 1935/4885CYP4F2 583/4885CYP4A11 562/4885

“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.