SCHEMBL5207015

SCHEMBL5207015

CCC(CC)(c1ccc(NC(=O)CCc2oc(Cl)nc2-c2ccc(Cl)cc2)cc1)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
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
PARP3 Q9Y6F1 1/20 0.37
CASP3 P42574 2/20 0.37
SENP8 Q96LD8 2/20 0.37
SENP7 Q9BQF6 2/20 0.37
SENP6 Q9GZR1 2/20 0.37
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 2/20 0.36
BLM P54132 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CHRM1 P11229 1/20 0.36
HTR2A P28223 1/20 0.36
MCHR1 Q99705 1/20 0.36
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL5211936 0.92 MAPT (0.42) MAPTMEN1KMT2ALMNAGLA
SCHEMBL5207462 0.90 MAPT (0.41) MAPTMEN1KMT2ALMNAGLA
SCHEMBL5208383 0.89 SMO (0.43) MAPTMEN1KMT2APARP3CASP3
SCHEMBL5207600 0.88 TP53 (0.44) MAPTMEN1KMT2ALMNAGLA
SCHEMBL6159244 0.87 HDAC1 (0.38) MAPTMEN1KMT2ALMNAGLA
SCHEMBL5215005 0.87 PARP3 (0.39) MAPTMEN1KMT2ALMNAGLA
SCHEMBL5210828 0.87 MAPT (0.41) MAPTMEN1KMT2ALMNAGLA
SCHEMBL5207440 0.86 CETP (0.47) MAPTMEN1KMT2AMAPK1TP53
SCHEMBL5208774 0.86 MAPT (0.39) MAPTMEN1KMT2ALMNAGLA
SCHEMBL5213773 0.86 PIK3CA (0.41) MAPTMEN1KMT2AMAPK1PARP3

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 MAPT 3958/4885MEN1 1626/4885KMT2A 680/4885

“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.