SCHEMBL5152299

SCHEMBL5152299

CCN(C)C(=O)c1cc(-c2ccc(OCCNC(=O)O)cc2)n(-c2ccc(OC)nc2)n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 5/20 0.43
MCL1 Q07820 4/20 0.43
BCL2 P10415 3/20 0.43
RPA1 P27694 6/20 0.42
MALT1 Q9UDY8 4/20 0.39
CHRNA7 P36544 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
OXTR P30559 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
FABP3 P05413 1/20 0.38
FABP4 P15090 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CG P48736 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
SCHEMBL5148755 0.93 MDM2 (0.40) MDM2MCL1BCL2RPA1MALT1
SCHEMBL14504646 0.90 MDM2 (0.45) MDM2MCL1BCL2RPA1MALT1
SCHEMBL5150854 0.89 MALT1 (0.44) MDM2MCL1BCL2RPA1MALT1
Hydrochloric Acid SCHEMBL5148947 0.87 MDM2 (0.43) MDM2MCL1BCL2RPA1MALT1
SCHEMBL5148813 0.87 RPA1 (0.47) MDM2MCL1BCL2RPA1MALT1
SCHEMBL5148826 0.86 MDM2 (0.43) MDM2MCL1BCL2RPA1MALT1
SCHEMBL5148944 0.86 FABP4 (0.43) MDM2MCL1BCL2RPA1MALT1
SCHEMBL6208574 0.86 MDM2 (0.41) MDM2MCL1BCL2RPA1MALT1
SCHEMBL5148724 0.84 BCL2 (0.45) MDM2MCL1BCL2RPA1OXTR
SCHEMBL5171475 0.83 RPA1 (0.42) MDM2MCL1BCL2RPA1MALT1

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
EP-1567503-B1 PYRAZOLE DERIVATIVES USEFUL AS COX-I INHIBITORS ASTELLAS PHARMA INC (JP) 2011-12-21 EP disclosed
US-20070112037-A1 Pyrazole Derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2007-05-17 US disclosed
US-7183306-B2 Pyrazole derivatives ASTELLAS PHARMA INC. (JP) 2007-02-27 US 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-20070112037-A1 Pyrazole Derivatives CYP11B2, CYP11B1, CYP3A43 MDM2 1492/4885MCL1 1748/4885BCL2 2334/4885

“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.