SCHEMBL17236554

SCHEMBL17236554

CC(C)(C)OC(=O)N1CCOC(c2ccc(Br)cn2)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 2/20 0.44
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RECQL P46063 1/20 0.39
MALT1 Q9UDY8 1/20 0.39
USP30 Q70CQ3 5/20 0.39
GPR119 Q8TDV5 3/20 0.39
HPGDS O60760 1/20 0.39
RORC P51449 2/20 0.39
TRPV3 Q8NET8 1/20 0.38
AKR1C3 P42330 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
SCHEMBL17224067 1.00 EPHA2 (0.44) EPHA2USP2SMN1; SMN2RECQLMALT1
SCHEMBL30373604 0.89 GPR119 (0.43) USP2SMN1; SMN2RECQLMALT1USP30
SCHEMBL18489091 0.87 NR1H2 (0.41) EPHA2USP2SMN1; SMN2RECQLMALT1
SCHEMBL30373606 0.87 GRIN2B (0.41) USP2SMN1; SMN2RECQLMALT1USP30
SCHEMBL17234418 0.87 NR1H2 (0.41) EPHA2USP2SMN1; SMN2RECQLMALT1
SCHEMBL17224078 0.86 USP2 (0.43) EPHA2USP2SMN1; SMN2RECQLMALT1
SCHEMBL31749447 0.85 GPR119 (0.45) USP2SMN1; SMN2MALT1USP30GPR119
SCHEMBL29628538 0.83 FPR2 (0.38) EPHA2USP30GPR119HPGDSRORC
SCHEMBL1993504 0.82 RORC (0.49) EPHA2USP2SMN1; SMN2RECQLUSP30
SCHEMBL503531 0.82 RORC (0.49) EPHA2USP2SMN1; SMN2RECQLUSP30

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
US-9840501-B2 Morpholin-pyridine derivatives HOFFMANN-LA ROCHE INC. (US) 2017-12-12 US disclosed
US-20170044145-A1 MORPHOLIN-PYRIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2017-02-16 US disclosed
WO-2015165835-A1 MORPHOLIN-PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2015-11-05 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-20170044145-A1 MORPHOLIN-PYRIDINE DERIVATIVES OPRM1, MC2R, OPRL1 EPHA2 3025/4885USP2 4606/4885SMN1; SMN2 1172/4885

“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.