SCHEMBL1552834

SCHEMBL1552834

OC(CCl)Cc1cc(C(F)(F)F)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.47
PDE2A O00408 4/20 0.43
CETP P11597 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 1/20 0.35
P2RX7 Q99572 1/20 0.35
PNMT P11086 1/20 0.34
IDH2 P48735 3/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
TMPRSS4 Q9NRS4 1/20 0.33
POLB P06746 1/20 0.33
USP30 Q70CQ3 1/20 0.33

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
SCHEMBL1552832 1.00 IDO1 (0.47) IDO1PDE2ACETPSLC6A2SLC6A4
SCHEMBL14402603 0.81 PDE2A (0.48) IDO1PDE2ACETPSLC6A2SLC6A4
SCHEMBL13849947 0.81 PDE2A (0.48) IDO1PDE2ACETPSLC6A2SLC6A4
SCHEMBL5198655 0.80 PDE2A (0.51) IDO1PDE2ACETPSLC6A2SLC6A4
SCHEMBL1552997 0.80 MEN1 (0.38) IDO1
SCHEMBL1552994 0.80 MEN1 (0.38) IDO1
SCHEMBL16758990 0.77 IDO1 (0.58) IDO1PDE2ASLC6A4P2RX7CA1
SCHEMBL8225527 0.76 IDO1 (0.53) IDO1PDE2ASLC6A2SLC6A4SLC6A3
SCHEMBL18896392 0.75 IDO1 (0.49) IDO1PDE2ACETPSLC6A2SLC6A4
SCHEMBL6293200 0.75 IDO1 (0.49) IDO1PDE2ACETPPNMTCA1

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-1844026-B1 MORPHOLINES AS 5HT2C AGONISTS HOFFMANN LA ROCHE (CH) 2011-04-27 EP disclosed
US-7323466-B2 Morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMAN-LA ROCHE INC. (US) 2008-01-29 US disclosed
EP-1844026-A2 MORPHOLINES AS 5HT2C AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2007-10-17 EP disclosed
US-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMANN-LA ROCHE INC. 2006-08-10 US disclosed
WO-2006077025-A2 MORPHOLINES AS 5HT2C AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-07-27 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-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HTR2C, HTR1A, HTR1B IDO1 749/4885PDE2A 356/4885CETP 1733/4885

“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.