SCHEMBL1822265

SCHEMBL1822265

CCOC(OCC)C(=N)NCc1ccc(OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
PKM P14618 1/20 0.54
LMNA P02545 3/20 0.49
HPGD P15428 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CASR P41180 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 2/20 0.46
EPHX2 P34913 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PPARG P37231 1/20 0.44

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
SCHEMBL558231 0.83 MEN1 (0.42) ALDH1A1LMNANPC1RAB9AMEN1
SCHEMBL1824023 0.82 PPID (0.45) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL558631 0.81 ALDH1A1 (0.57) ALDH1A1PKMLMNAEPHX2MEN1
SCHEMBL22778042 0.80 PPARG (0.49) ALDH1A1EPHX2PPARG
SCHEMBL14391600 0.80 MAPK1 (0.33) ALDH1A1PKMLMNAHPGDEPHX2
SCHEMBL558676 0.77 MEN1 (0.45) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL558635 0.76 TSHR (0.57) ALDH1A1LMNAHPGDSMN1; SMN2MEN1
SCHEMBL4093144 0.75 ALDH1A1 (0.62) ALDH1A1PKMLMNAHPGDSMN1; SMN2
SCHEMBL5793985 0.75 ALDH1A1 (0.62) ALDH1A1PKMLMNAHPGDSMN1; SMN2
SCHEMBL21634929 0.74 CARM1 (0.35) ALDH1A1SMN1; SMN2MEN1KMT2APPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2315761-B1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LTD (GB) 2018-07-11 EP disclosed
US-8461339-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (US) 2013-06-11 US disclosed
US-20110130394-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2011-06-02 US disclosed
EP-2315761-A1 PHARMACEUTICAL COMPOUNDS Sentinel Oncology Limited (GB) 2011-05-04 EP disclosed
WO-2010007374-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2010-01-21 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-20110130394-A1 PHARMACEUTICAL COMPOUNDS NR2C2, NR3C2, NR0B2 ALDH1A1 4706/4885PKM 2263/4885LMNA 2371/4885

“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.