SCHEMBL4132562

SCHEMBL4132562

O=C(C1(c2cc(O)cc(Cl)c2O)CCCCC1)C1(c2cc(O)cc(Cl)c2O)CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 5/20 0.37
PDE7A Q13946 4/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
HSD11B1 P28845 3/20 0.33
TTR P02766 1/20 0.32
PDE7B Q9NP56 1/20 0.32
SPR P35270 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
FTO Q9C0B1 1/20 0.31

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
SCHEMBL4132565 0.75 ERN1 (0.33) HSD17B10CYP3A4HPGDCRHBPCRHR2
SCHEMBL31729576 0.69 HDAC4 (0.69) HDAC4CRHBPCRHR2KMT2A
SCHEMBL3389625 0.69 HDAC4 (0.69) HDAC4CRHBPCRHR2KMT2A
SCHEMBL11809082 0.69 ESR1 (0.43) PDE7AHSD17B10CYP3A4HPGDCRHBP
SCHEMBL27586088 0.67 AKR1C1 (0.48) HDAC4PDE7AHSD11B1KMT2A
SCHEMBL3391455 0.67 HDAC4 (0.47) HDAC4CYP3A4HPGDKMT2A
SCHEMBL9539224 0.65 ALDH1A1 (0.48) PDE7AHSD17B10CYP3A4HPGDTTR
SCHEMBL70463 0.63 HSD17B10 (0.65) HSD17B10CYP3A4HPGDCRHBPCRHR2
SCHEMBL2574718 0.63 HSD17B10 (0.65) HSD17B10CYP3A4HPGDCRHBPCRHR2
SCHEMBL27974576 0.63 ESR1 (0.57) HDAC4HSD11B1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090221596-A1 Substtituted aryl oximes BAYER CROPSCIENCE AG (DE) 2009-09-03 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-20090221596-A1 Substtituted aryl oximes CYP1A1, PRDX1, CYP1A2 HDAC4 3233/4885PDE7A 4147/4885HSD17B10 1562/4885

“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.