SCHEMBL5215345

SCHEMBL5215345

CCOC(=O)CCc1oc(Cl)nc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
MAPT P10636 2/20 0.44
PTPN1 P18031 1/20 0.44
TP53 P04637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
FAAH O00519 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PARP1 P09874 1/20 0.44
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
SLC2A2 P11168 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL1363159 0.90 HSD17B10 (0.46) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL5402803 0.87 KDM4E (0.43) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL5208950 0.82 HSD17B10 (0.44) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL1361961 0.81 FAAH (0.51) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL7457504 0.81 FAAH (0.43) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL10832406 0.79 MAPT (0.47) ALDH1A1MAPTADORA3
SCHEMBL5211851 0.78 HSD17B10 (0.48) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL1362553 0.77 CYP11B1 (0.43) KDM4EALDH1A1KMT2AMEN1CYP1A2
SCHEMBL5213765 0.76 RXRA (0.46) KDM4EKMT2AMEN1TP53
SCHEMBL5212455 0.75 CYP11B1 (0.43) ALDH1A1KMT2AMEN1MAPTTP53

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 2 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

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 KDM4E 2428/4885ALDH1A1 1651/4885HPGD 958/4885

“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.