SCHEMBL1553056

SCHEMBL1553056

Cc1cccc(CC2OCCN(Cc3ccccc3)C2=O)c1

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.56
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP3A4 P08684 1/20 0.45
RECQL P46063 1/20 0.45
ACHE P22303 1/20 0.42
BACE1 P56817 1/20 0.42
MAPT P10636 2/20 0.42
CLPP Q16740 1/20 0.41
CES2 O00748 1/20 0.41
BRD4 O60885 1/20 0.41
BCHE P06276 1/20 0.40
ALOX12 P18054 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL22237462 0.92 TACR1 (0.48) TACR1MEN1KMT2APOLBALDH1A1
SCHEMBL22623154 0.89 MAPT (0.51) TACR1MEN1KMT2APOLBALDH1A1
SCHEMBL5968243 0.85 TACR1 (0.56) TACR1ALDH1A1
SCHEMBL1551999 0.85 TACR1 (0.56) TACR1MEN1KMT2ATDP1KDM4E
SCHEMBL5667214 0.85 TACR1 (0.56) TACR1ALDH1A1
SCHEMBL1553263 0.84 TACR1 (0.53) TACR1CYP3A4
SCHEMBL22237459 0.80 TACR1 (0.49) TACR1MEN1KMT2ACLPP
SCHEMBL9598749 0.80 TACR1 (0.55) TACR1MEN1KMT2APOLBALDH1A1
SCHEMBL1552469 0.79 TACR1 (0.58) TACR1MEN1KMT2A
SCHEMBL2567720 0.79 TACR1 (0.59) TACR1MEN1KMT2APOLBALDH1A1

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
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
US-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMANN-LA ROCHE INC. 2006-08-10 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 (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 88/4885MEN1 688/4885KMT2A 1191/4885

“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.