SCHEMBL5527482

SCHEMBL5527482

CCN(C)C(=O)c1cc(-c2ccc(OCc3ccccc3)cn2)n(-c2ccc(OC)nc2)n1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 4/20 0.44
BCL2 P10415 3/20 0.43
MCL1 Q07820 3/20 0.43
MEN1 O00255 1/20 0.42
PABPC1 P11940 1/20 0.42
KMT2A Q03164 1/20 0.42
RPA1 P27694 2/20 0.39
P4HTM Q9NXG6 1/20 0.39
MGLL Q99685 1/20 0.38
OXTR P30559 4/20 0.37
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 2/20 0.36
ACACB O00763 2/20 0.35
ACACA Q13085 2/20 0.35
AVPR1A P37288 1/20 0.35
ALKBH1 Q13686 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
SCHEMBL5522053 0.90 MDM2 (0.46) MDM2BCL2MCL1MEN1KMT2A
SCHEMBL5526239 0.89 MDM2 (0.41) MDM2BCL2MCL1MEN1PABPC1
SCHEMBL5269383 0.89 MDM2 (0.57) MDM2BCL2MCL1MEN1PABPC1
SCHEMBL5522027 0.86 OXTR (0.39) MDM2BCL2MCL1RPA1OXTR
SCHEMBL5269418 0.86 MDM2 (0.46) MDM2BCL2MCL1MEN1PABPC1
SCHEMBL5525538 0.86 OXTR (0.36) RPA1MGLLOXTRAVPR1A
SCHEMBL5531773 0.84 OXTR (0.39) MDM2BCL2MCL1RPA1OXTR
SCHEMBL5524300 0.84 CYP11B1 (0.37) OXTRAVPR1A
SCHEMBL5519701 0.83 MDM2 (0.44) MDM2BCL2MCL1MEN1PABPC1
SCHEMBL14416570 0.82 BCL2 (0.40) MDM2BCL2MCL1RPA1MGLL

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-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
EP-1698626-A1 AMIDOPYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 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-20070219210-A1 Amidopyrazole Derivative PTGER1, PTGS1, PTGER2 MDM2 4288/4885BCL2 3148/4885MCL1 1451/4885

“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.