SCHEMBL1552545

SCHEMBL1552545

CC(C)(C)OC(=O)N1CCO[C@H](Cc2ccccc2O)C1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.41
USP30 Q70CQ3 1/20 0.41
TERT O14746 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.41
SMARCA2 P51531 2/20 0.41
SMARCA4 P51532 2/20 0.41
PBRM1 Q86U86 2/20 0.41
EPHA2 P29317 4/20 0.41
GPR119 Q8TDV5 2/20 0.40
MAPT P10636 2/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
NAMPT P43490 1/20 0.39
ERBB2 P04626 1/20 0.39
EPHB4 P54760 1/20 0.39
NR1H4 Q96RI1 1/20 0.39

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
SCHEMBL27695185 1.00 KDM1A (0.41) KDM1AUSP30TERTSMN1; SMN2USP2
SCHEMBL27695130 0.85 EPHA2 (0.47) USP30SMN1; SMN2USP2EPHA2GPR119
SCHEMBL1551911 0.85 EPHA2 (0.47) USP30SMN1; SMN2USP2EPHA2GPR119
SCHEMBL4476703 0.85 JAK2 (0.49) USP30SMN1; SMN2USP2EPHA2GPR119
SCHEMBL1552491 0.83 NR1H4 (0.41) USP30SMN1; SMN2EPHA2GPR119MAPT
SCHEMBL27715084 0.83 NR1H4 (0.41) USP30SMN1; SMN2EPHA2GPR119MAPT
SCHEMBL13482008 0.82 EPHA2 (0.51) EPHA2GPR119ERBB2EPHB4NR1H4
SCHEMBL31076372 0.82 MAPT (0.43) SMN1; SMN2USP2EPHA2MAPTERBB2
SCHEMBL5297895 0.81 DRD4 (0.45) USP30EPHA2GPR119ERBB2EPHB4
SCHEMBL1551948 0.81 USP2 (0.43) KDM1ASMN1; SMN2USP2EPHA2GPR119

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 7 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
CN-101107235-B Morpholines as 5HT2C agonists HOFFMANN LA ROCHE 2011-03-16 CN 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
CN-101107235-A Morpholines as 5HT2C agonists HOFFMANN LA ROCHE (CH) 2008-01-16 CN 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 KDM1A 1231/4885USP30 3917/4885TERT 4758/4885

“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.