SCHEMBL4853167

SCHEMBL4853167

COc1cc(COc2nn(-c3ccccc3)cc2C=CP(=O)(O)O)ccc1OCc1nc(-c2ccccc2)sc1C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 12/20 0.40
F2 P00734 1/20 0.36
KDM4E B2RXH2 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 2/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MITF O75030 1/20 0.35
MAPK1 P28482 1/20 0.35
LMNA P02545 1/20 0.35
PTGER4 P35408 1/20 0.34
PTGER2 P43116 1/20 0.34

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
SCHEMBL4853130 1.00 F2RL3 (0.40) F2RL3F2KDM4EMEN1KMT2A
SCHEMBL4850827 0.90 PPARD (0.42) KDM4EMEN1KMT2APOLBMAPT
SCHEMBL4850791 0.90 PPARD (0.42) KDM4EMEN1KMT2APOLBMAPT
SCHEMBL4848592 0.89 F2RL3 (0.42) F2RL3F2KDM4EMEN1KMT2A
SCHEMBL4846073 0.87 MEN1 (0.38) F2RL3F2KDM4EMEN1KMT2A
SCHEMBL4846013 0.87 MEN1 (0.38) F2RL3F2KDM4EMEN1KMT2A
SCHEMBL4845738 0.87 PPARG (0.43) POLBMAPT
SCHEMBL4845730 0.87 PPARG (0.43) POLBMAPT
SCHEMBL4848818 0.86 KDM4E (0.41) F2RL3F2KDM4EMEN1KMT2A
SCHEMBL4848785 0.86 KDM4E (0.41) F2RL3F2KDM4EMEN1KMT2A

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
US-7368578-B2 Five-membered heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-06 US disclosed
US-20060135578-A1 Five-membered heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-22 US disclosed
EP-1541564-A1 FIVE-MEMBERED HETEROCYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2005-06-15 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-20060135578-A1 Five-membered heterocyclic compounds GPR119, OR10J3, CYP11B1 F2RL3 4515/4885F2 2042/4885KDM4E 719/4885

“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.