SCHEMBL1551999

SCHEMBL1551999

O=C1C(Cc2cccc(Br)c2)OCCN1Cc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.56
CLPP Q16740 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
MMP2 P08253 1/20 0.39
NPC1 O15118 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
FAAH O00519 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
NR3C1 P04150 1/20 0.37

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
SCHEMBL5968243 0.85 TACR1 (0.56) TACR1SIGMAR1MMP2
SCHEMBL5667214 0.85 TACR1 (0.56) TACR1SIGMAR1MMP2
SCHEMBL1553056 0.85 TACR1 (0.56) TACR1CLPPTDP1KMT2AKDM4E
SCHEMBL1553263 0.79 TACR1 (0.53) TACR1
SCHEMBL2567720 0.79 TACR1 (0.59) TACR1KMT2AMEN1
SCHEMBL22237459 0.78 TACR1 (0.49) TACR1CLPPSIGMAR1KMT2AMEN1
SCHEMBL22237462 0.78 TACR1 (0.48) TACR1TDP1KMT2AKDM4EMEN1
SCHEMBL30819028 0.78 TACR1 (0.58) TACR1SIGMAR1KMT2AMEN1
SCHEMBL9598749 0.77 TACR1 (0.55) TACR1SIGMAR1SMN1; SMN2TDP1KMT2A
SCHEMBL20832666 0.75 TACR1 (0.46) TACR1SIGMAR1SMN1; SMN2MAPT

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 TACR1 88/4885CLPP 4813/4885SIGMAR1 46/4885

“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.