SCHEMBL5152277

SCHEMBL5152277

COc1ccc(-n2nc(Cl)cc2-c2ccc(OCCNC(=O)O)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.52
RPA1 P27694 4/20 0.50
CCKAR P32238 10/20 0.49
FABP3 P05413 1/20 0.48
FABP4 P15090 1/20 0.48
MARS1 P56192 1/20 0.48
ALOX5 P09917 1/20 0.48
PTGS2 P35354 1/20 0.48
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46

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
SCHEMBL5147814 0.91 MALT1 (0.51) MALT1RPA1CCKARFABP3FABP4
SCHEMBL5171475 0.89 RPA1 (0.42) MALT1RPA1CCKARFABP3FABP4
SCHEMBL5148979 0.88 RPA1 (0.50) MALT1RPA1CCKARFABP3FABP4
SCHEMBL5150633 0.88 MALT1 (0.48) MALT1RPA1CCKARFABP3FABP4
SCHEMBL5420997 0.88 RPA1 (0.67) MALT1RPA1MARS1
SCHEMBL5152356 0.87 RPA1 (0.48) MALT1RPA1CCKARFABP3FABP4
SCHEMBL5147704 0.87 CCKAR (0.49) MALT1RPA1CCKARFABP3FABP4
SCHEMBL5150407 0.86 BCL2 (0.50) MALT1RPA1CCKARFABP3FABP4
SCHEMBL5148715 0.86 RPA1 (0.47) MALT1RPA1CCKARFABP3FABP4
SCHEMBL5147727 0.85 RPA1 (0.54) MALT1RPA1CCKARFABP3FABP4

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 6 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
EP-1567503-A1 PYRAZOLE DERIVATIVES USEFUL AS COX-I INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-08-31 EP disclosed
US-20040116475-A1 Pyrazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-17 US disclosed
WO-2004050632-A1 PYRAZOLE DERIVATIVES USEFUL AS COX-I INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-17 WO 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 MALT1 1227/4885RPA1 2143/4885CCKAR 1377/4885

“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.