SCHEMBL10272869

SCHEMBL10272869

CO/N=C(\C)c1cccc(CCCO/N=C(\C)c2cccc(-c3ccccc3O)n2)n1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD17B14 Q9BPX1 8/20 0.34
CYP4F2 P78329 2/20 0.32
CYP4A11 Q02928 2/20 0.32
PTGER1 P34995 2/20 0.32
ALDH1A1 P00352 1/20 0.31
HPGD P15428 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
SCHEMBL882874 0.88 ALDH1A1 (0.43) PTGER1ALDH1A1HPGD
SCHEMBL10273200 0.88 CNR2 (0.41) PTGER1
SCHEMBL10273816 0.86 PDE10A (0.36) CYP4F2CYP4A11
SCHEMBL10272878 0.83 KCNH2 (0.35) CYP4F2CYP4A11
SCHEMBL10272863 0.82 PPARG (0.32) ALDH1A1HPGD
SCHEMBL10272877 0.82 KCNH2 (0.36) CYP4F2CYP4A11
SCHEMBL10272874 0.82 KCNH2 (0.34) CYP4F2CYP4A11
SCHEMBL16172520 0.81 KCNH2 (0.35) CYP4F2CYP4A11
SCHEMBL10272867 0.81 SMN1; SMN2 (0.47) CYP4F2CYP4A11ALDH1A1
SCHEMBL882894 0.81 HSP90AA1 (0.38) CYP4F2CYP4A11

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-20140309244-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-10-16 US disclosed
US-20140309244-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-10-16 US disclosed
WO-2012038521-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-03-29 WO 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-20140309244-A1 NOVEL MICROBIOCIDES MSR1, C3AR1, CD209 HSD17B14 996/4885CYP4F2 1570/4885CYP4A11 1681/4885

“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.