SCHEMBL3216583

SCHEMBL3216583

CCOC(=O)c1cc(OC)cc(OCC)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
PKM P14618 1/20 0.58
BRD4 O60885 1/20 0.53
BRD2 P25440 1/20 0.53
CREBBP Q92793 1/20 0.53
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53
CA14 Q9ULX7 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
CYP3A4 P08684 1/20 0.51
HPGD P15428 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HSD17B2 P37059 1/20 0.47
POLB P06746 1/20 0.47
SIRT3 Q9NTG7 1/20 0.46
BRAF P15056 1/20 0.46

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
SCHEMBL3258075 0.93 MEN1 (0.64) MEN1KMT2APKMCA12CA1
SCHEMBL14613473 0.89 CA12 (0.60) MEN1KMT2APKMCA12CA1
SCHEMBL19511448 0.85 MEN1 (0.51) MEN1KMT2APKMBRD4BRD2
SCHEMBL2259938 0.84 CA12 (0.55) MEN1KMT2ABRD4BRD2CREBBP
SCHEMBL4328949 0.83 CYP2C19 (0.58) MEN1KMT2APKMCA12CA1
SCHEMBL31135164 0.83 MEN1 (0.55) MEN1KMT2APKMCA12CA1
SCHEMBL14374036 0.83 CA12 (0.73) MEN1KMT2APKMCA12CA1
SCHEMBL4757744 0.83 MEN1 (0.55) MEN1KMT2APKMCA12CA1
SCHEMBL3176831 0.83 CYP2C9 (0.58) MEN1KMT2APKMBRD4BRD2
SCHEMBL288382 0.83 BRD4 (0.53) MEN1KMT2APKMBRD4BRD2

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-20100029647-A1 3,4,(5)-SUBSTITUTED TETRAHYDROPHYRIDINES NOVARTIS AG (CH) 2010-02-04 US disclosed
EP-1841740-A1 3,4,(5)-SUBSTITUTED TETRAHVDROPYRIDINES Novartis AG (CH) 2007-10-10 EP disclosed
WO-2006074924-A1 3,4,(5)-SUBSTITUTED TETRAHVDROPYRIDINES NOVARTIS AG (CH) 2006-07-20 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-20100029647-A1 3,4,(5)-SUBSTITUTED TETRAHYDROPHYRIDINES REN, PAH, ACE MEN1 1534/4885KMT2A 3027/4885PKM 891/4885

“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.