SCHEMBL4800783

SCHEMBL4800783

O=C(OCc1ccccc1)N1CCOC(CCO)(c2ccc(F)c(F)c2)C1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TACR2 P21452 1/20 0.46
RORC P51449 4/20 0.44
MCHR1 Q99705 1/20 0.41
PTGDR2 Q9Y5Y4 9/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
DPP4 P27487 1/20 0.39
CYP2C19 P33261 1/20 0.38

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
SCHEMBL7186563 0.83 TACR2 (0.49) MEN1KMT2ATACR2NPC1CYP2C19
SCHEMBL4631267 0.83 TACR2 (0.62) TACR2DPP4
SCHEMBL4800637 0.81 MEN1 (0.47) MEN1KMT2ANPSR1RORCMCHR1
SCHEMBL27418056 0.79 TACR2 (0.59) TACR2
SCHEMBL7174179 0.79 TACR2 (0.43) KMT2ATACR2RORC
SCHEMBL7180636 0.79 TACR2 (0.43) KMT2ATACR2RORC
Hydrochloric Acid SCHEMBL4802792 0.78 TACR2 (0.42) KMT2ATACR2RORC
Hydrochloric Acid SCHEMBL4800620 0.78 TACR2 (0.42) KMT2ATACR2RORC
SCHEMBL30702474 0.77 RORC (0.51) MEN1KMT2ANPSR1RORCMCHR1
SCHEMBL31567123 0.77 RORC (0.51) MEN1KMT2ANPSR1RORCMCHR1

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
US-7378521-B2 Preparation of 2-(2-arylmorpholin-2-yl) ethanol derivatives and intermediates SANOFI-AVENTIS (FR) 2008-05-27 US disclosed
US-20070167623-A1 PREPARATION OF 2-(2-ARYLMORPHOLIN-2-YL) ETHANOL DERIVATIVES AND INTERMEDIATES SANOFI-AVENTIS (FR) 2007-07-19 US disclosed
US-7223860-B2 Preparation of 2-(2-arylmorpholin-2-yl) ethanol derivatives and intermediates SANOFI-AVENTIS (FR) 2007-05-29 US disclosed
US-20060149058-A1 Preparation of 2-(2-arylmorpholin-2-yl) ethanol derivatives and intermediates SANOFI-AVENTIS (FR) 2006-07-06 US disclosed
US-7038044-B1 Method for preparing 2-(2-arylmorpholin-2-yl)ethanol derivatives and intermediates SANOFI-AVENTIS (FR) 2006-05-02 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 (2 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-20070167623-A1 PREPARATION OF 2-(2-ARYLMORPHOLIN-2-YL) ETHANOL DERIVATIVES AND INTERMEDIATES ADH1C, ADH1A, ADH5 MEN1 2209/4885KMT2A 1327/4885NPSR1 157/4885
US-20060149058-A1 Preparation of 2-(2-arylmorpholin-2-yl) ethanol derivatives and intermediates ADH1C, ADH1A, ADH5 MEN1 2209/4885KMT2A 1327/4885NPSR1 157/4885

“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.