SCHEMBL4132565

SCHEMBL4132565

O=CC1(c2cc(O)cc(Cl)c2O)CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.33
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL4132562 0.75 HDAC4 (0.37) CYP3A4HPGDCRHBPCRHR2HSD17B10
SCHEMBL15862645 0.68 PDE7A (0.40) TSHR
SCHEMBL11809082 0.67 ESR1 (0.43) CYP3A4HPGDCRHBPCRHR2HSD17B10
SCHEMBL3389630 0.67 HDAC4 (0.49) CRHBPCRHR2TSHRKMT2A
SCHEMBL7169878 0.67 CYP26B1 (0.40) CYP3A4
SCHEMBL28988665 0.65 ESR2 (0.55) CYP3A4HPGDHSD17B10TSHRKMT2A
SCHEMBL3516295 0.65 SLC6A4 (0.51) CYP2D6
SCHEMBL9539224 0.63 ALDH1A1 (0.48) ERN1CYP3A4HPGDHSD17B10TSHR
SCHEMBL70463 0.62 HSD17B10 (0.65) CYP3A4HPGDCRHBPCRHR2HSD17B10
SCHEMBL2574718 0.62 HSD17B10 (0.65) CYP3A4HPGDCRHBPCRHR2HSD17B10

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 ERN1 961/4885CYP3A4 84/4885HPGD 2666/4885

“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.