SCHEMBL10272863

SCHEMBL10272863

CO/N=C(\C)c1cccc(CCCO/N=C(\C)c2cccc(-c3cc(C)ccc3C)n2)n1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.32
PPARA Q07869 3/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CTSA P10619 2/20 0.31
KCNH2 Q12809 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
SCHEMBL10272869 0.82 HSD17B14 (0.34) ALDH1A1HPGD
SCHEMBL10273200 0.82 CNR2 (0.41) CTSAKCNH2
SCHEMBL882874 0.82 ALDH1A1 (0.43) PPARGPPARAMEN1KMT2AALDH1A1
SCHEMBL10273816 0.81 PDE10A (0.36) PPARGPPARAMEN1KMT2A
SCHEMBL882894 0.81 HSP90AA1 (0.38) PPARGPPARAMEN1KMT2AKCNH2
SCHEMBL10272878 0.80 KCNH2 (0.35) PPARGPPARAMEN1KMT2AKCNH2
SCHEMBL882870 0.80 PPARA (0.32) PPARGPPARAKCNH2
SCHEMBL16164006 0.80 KCNH2 (0.32) PPARGPPARAKCNH2
SCHEMBL883003 0.80 KCNH2 (0.32) PPARGPPARAKCNH2
SCHEMBL10272877 0.79 KCNH2 (0.36) PPARGPPARAKCNH2

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 PPARG 3152/4885PPARA 3301/4885MEN1 1521/4885

“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.