SCHEMBL2920703

SCHEMBL2920703

COc1ccc(-n2nc(C(=O)O)cc2-c2ccccc2F)cn1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
RPA1 P27694 6/20 0.51
MEN1 O00255 2/20 0.49
MDM2 Q00987 4/20 0.43
MCL1 Q07820 4/20 0.43
BCL2 P10415 3/20 0.43
MARS1 P56192 1/20 0.43
PTGS2 P35354 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42

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
SCHEMBL2912492 0.89 KMT2A (0.54) KMT2ARPA1MEN1MDM2MCL1
SCHEMBL2911844 0.88 RPA1 (0.52) KMT2ARPA1MEN1MDM2MCL1
SCHEMBL2917043 0.87 TP53 (0.48) KMT2AMEN1PTGS2
SCHEMBL2910437 0.85 RPA1 (0.70) KMT2ARPA1MEN1MDM2MCL1
SCHEMBL2915954 0.84 MGLL (0.49)
SCHEMBL2916975 0.82 KMT2A (0.62) KMT2ARPA1MEN1MDM2MCL1
SCHEMBL2910507 0.82 KMT2A (0.56) KMT2ARPA1MEN1MDM2MCL1
SCHEMBL13213095 0.81 OXTR (0.39) KMT2AMEN1PTGS2ABCG2
SCHEMBL2918250 0.81 RPA1 (0.52) KMT2ARPA1MEN1MDM2MCL1
SCHEMBL2909802 0.79 RPA1 (0.49) KMT2ARPA1MEN1MDM2MCL1

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-1591443-B1 PYRAZOLE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2010-08-25 EP disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-20060128685-A1 Pyrazole derivative DAIICHI PHARMACEUTICAL CO., LTD., (JP) 2006-06-15 US disclosed
EP-1591443-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-02 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-20060128685-A1 Pyrazole derivative PTGS1, PTGS2, PTGER1 KMT2A 4370/4885RPA1 4200/4885MEN1 4127/4885

“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.