SCHEMBL390968

SCHEMBL390968

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

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 2/20 0.42
USP30 Q70CQ3 5/20 0.42
RORC P51449 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
USP2 O75604 1/20 0.39
GPR119 Q8TDV5 4/20 0.38
RECQL P46063 1/20 0.38
HPGDS O60760 1/20 0.38
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL3331679 0.83 GPR119 (0.48) USP30SMN1; SMN2USP2GPR119HPGDS
SCHEMBL3186642 0.83 GPR119 (0.48) USP30SMN1; SMN2USP2GPR119HPGDS
SCHEMBL390649 0.81 USP30 (0.48) USP30GPR119RECQL
SCHEMBL14280850 0.81 USP30 (0.43) USP30RORCSMN1; SMN2GPR119MEN1
SCHEMBL17224067 0.81 EPHA2 (0.44) EPHA2USP30RORCSMN1; SMN2USP2
SCHEMBL17236554 0.81 EPHA2 (0.44) EPHA2USP30RORCSMN1; SMN2USP2
SCHEMBL387472 0.79 KDM4E (0.42) SMN1; SMN2TSHR
SCHEMBL17224078 0.78 USP2 (0.43) EPHA2USP30SMN1; SMN2USP2GPR119
SCHEMBL28659302 0.77 EPHA2 (0.44) EPHA2USP30RORCSMN1; SMN2USP2
SCHEMBL31223095 0.77 PDE4B (0.47) EPHA2USP30RORCGPR119RECQL

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101764-B2 MCH receptor antagonists ELI LILLY AND COMPANY (US) 2012-01-24 US disclosed
US-20100016350-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY 2010-01-21 US disclosed
EP-2029610-A2 NOVEL MCH RECEPTOR ANTAGONISTS Eli Lilly & Company (US) 2009-03-04 EP disclosed
WO-2007146759-A2 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2007-12-21 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-20100016350-A1 NOVEL MCH RECEPTOR ANTAGONISTS MCHR1, MCHR2, MC1R EPHA2 770/4885USP30 2497/4885RORC 128/4885

“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.