SCHEMBL4101567

SCHEMBL4101567

CC(C)Oc1ccc(-n2c(C(=O)O)c(NC(=O)c3ccc(Cl)cc3)c3nc(Oc4cccc(Cl)c4)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 6/20 0.43
MCL1 Q07820 5/20 0.43
BCL2 P10415 4/20 0.43
PPARG P37231 3/20 0.40
GCK P35557 1/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
USP36 Q9P275 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
MEN1 O00255 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
GRM5 P41594 2/20 0.37
PTGER4 P35408 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL4090165 0.85 PPARG (0.42) MDM2MCL1BCL2PPARGEGLN1
SCHEMBL4095158 0.77 ADRB3 (0.38) PPARGMAPTEGLN1HRH3
SCHEMBL4094387 0.76 PTGES (0.47) MDM2MCL1BCL2PPARGMAPT
SCHEMBL4095879 0.73 PPARG (0.43) MDM2MCL1BCL2PPARGPTGER4
SCHEMBL333839 0.72 PPARG (0.47) MDM2MCL1BCL2PPARGKDM4E
SCHEMBL4701667 0.72 PTGES (0.46) MDM2MCL1BCL2PPARGMAPT
SCHEMBL4224601 0.70 PTGES (0.58) MDM2MCL1BCL2PPARGKDM4E
SCHEMBL4095050 0.70 PTGES (0.48) MDM2MCL1BCL2PPARGGCK
SCHEMBL333958 0.70 KDM4E (0.42) PPARGMAPTKDM4EMEN1HTT
SCHEMBL333957 0.68 MAPT (0.42) PPARGMAPTKDM4EHTT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048285-A1 Pyrrolopyridines Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-02-19 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-20090048285-A1 Pyrrolopyridines Useful in the Treatment of Inflammation PYCR1, ARG2, ARG1 MDM2 2780/4885MCL1 1709/4885BCL2 802/4885

“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.