SCHEMBL5211482

SCHEMBL5211482

CCOP(=O)(OCC)c1ccc(NC(=O)CCc2oc(-n3cnc4ccccc43)nc2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.43
EPHX2 P34913 1/20 0.43
MAPT P10636 5/20 0.39
POLB P06746 2/20 0.39
MEN1 O00255 2/20 0.37
LMNA P02545 2/20 0.37
KMT2A Q03164 2/20 0.37
AURKA O14965 1/20 0.37
GLA P06280 1/20 0.37
MAPK1 P28482 1/20 0.37
TNKS O95271 1/20 0.37
THRB P10828 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CETP P11597 3/20 0.36
TP53 P04637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
CEPT1 Q9Y6K0 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL5211723 0.96 LTA4H (0.41) LTA4HEPHX2MAPTPOLBMEN1
SCHEMBL5207019 0.90 MAPT (0.39) LTA4HEPHX2MAPTPOLBMEN1
SCHEMBL5211116 0.89 MAPT (0.38) MAPTPOLBMEN1LMNAKMT2A
SCHEMBL5211421 0.89 TNKS (0.42) MAPTPOLBMEN1LMNAKMT2A
SCHEMBL5211229 0.89 MAPT (0.38) MAPTPOLBMEN1LMNAKMT2A
SCHEMBL5210089 0.88 MAPT (0.37) MAPTPOLBMEN1LMNAKMT2A
SCHEMBL5212758 0.87 MAPT (0.38) MAPTPOLBMEN1LMNAKMT2A
SCHEMBL5215192 0.87 PIN1 (0.43) MAPTPOLBAURKATNKSCETP
SCHEMBL5212587 0.86 THRB (0.50) MAPTMEN1LMNAKMT2AAURKA
SCHEMBL5210929 0.86 MAPT (0.38) MAPTPOLBAURKATHRBRXFP1

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-7183276-B2 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-20050090534-A1 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-28 US disclosed
EP-1486490-A1 AZOLE COMPOUNDS Takeda Chemical Industries, Ltd. (JP) 2004-12-15 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-20050090534-A1 Azole compounds AHR, NR0B2, NR2C2 LTA4H 2682/4885EPHX2 1043/4885MAPT 3958/4885

“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.