SCHEMBL5207604

SCHEMBL5207604

CCOP(=O)(Cc1ccc(NC(=O)CCc2oc(-c3ccc(F)cc3)nc2-c2ccc(Cl)cc2)cc1)OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.47
MAPT P10636 4/20 0.46
CETP P11597 5/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
GLA P06280 1/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
PARP3 Q9Y6F1 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
MAOB P27338 1/20 0.39
KDR P35968 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL5207445 0.91 MEN1 (0.49) TP53MAPTCETPMEN1KMT2A
SCHEMBL5215008 0.89 MAPT (0.41) TP53MAPTCETPMEN1KMT2A
SCHEMBL5207021 0.89 MAPT (0.44) TP53MAPTMEN1KMT2ALMNA
SCHEMBL5211940 0.88 MAPT (0.45) TP53MAPTCETPMEN1KMT2A
SCHEMBL5213177 0.88 MAPT (0.40) TP53MAPTCETPMEN1KMT2A
SCHEMBL5211339 0.88 MAPT (0.47) TP53MAPTCETPMEN1KMT2A
SCHEMBL5207465 0.86 MAPT (0.44) TP53MAPTCETPMEN1KMT2A
SCHEMBL5208944 0.86 HDAC1 (0.42) TP53MAPTMEN1KMT2ALMNA
SCHEMBL5210833 0.85 MAPT (0.46) TP53MAPTMEN1KMT2ALMNA
SCHEMBL5214835 0.85 MAPT (0.40) TP53MAPTMEN1KMT2ALMNA

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 TP53 4375/4885MAPT 3958/4885CETP 3930/4885

“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.