SCHEMBL3988752

SCHEMBL3988752

O=C(O)N1CCC(COc2ccc(Br)cn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.44
ACHE P22303 2/20 0.44
GPR119 Q8TDV5 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
POLB P06746 1/20 0.40
HCRTR2 O43614 3/20 0.39
ACACB O00763 3/20 0.38
HCRTR1 O43613 1/20 0.38
KDM4E B2RXH2 1/20 0.38
KDM1A O60341 1/20 0.38
EP300 Q09472 1/20 0.38
CYP4F2 P78329 2/20 0.37
CYP4A11 Q02928 2/20 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
SCHEMBL15512546 0.88 HRH3 (0.43) LIPEACHEGPR119HRH3HCRTR2
SCHEMBL15512545 0.88 HRH3 (0.43) LIPEACHEGPR119HRH3HCRTR2
SCHEMBL387056 0.83 GPR119 (0.49) GPR119KDM4E
SCHEMBL865849 0.83 GPR119 (0.52) GPR119
SCHEMBL24493183 0.83 GRIN2B (0.55) ACHE
SCHEMBL30578289 0.83 GRIN2B (0.55) ACHE
SCHEMBL4055411 0.83 LIPE (0.41) LIPEACHEGPR119HRH3KDM1A
SCHEMBL20893509 0.82 GRIN2B (0.44) ACHEHRH3POLBACACBCYP4F2
SCHEMBL16758168 0.81 LIPE (0.48) LIPEACHEGPR119HRH3HCRTR2
SCHEMBL16758078 0.81 LIPE (0.48) LIPEACHEGPR119HRH3HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3074384-B1 AMIDE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2019-05-22 EP disclosed
US-9776987-B2 Amide derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2017-10-03 US disclosed
US-20170129875-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2017-05-11 US disclosed
EP-3074384-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST Chong Kun Dang Pharmaceutical Corp. (KR) 2016-10-05 EP disclosed
WO-2015080446-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2015-06-04 WO disclosed
EP-2858986-A1 PIPERIDINE DERIVATIVES FOR GPR119 AGONIST Chong Kun Dang Pharmaceutical Corp. (KR) 2015-04-15 EP disclosed
WO-2013187646-A1 PIPERIDINE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2013-12-19 WO disclosed
EP-2059516-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (publ) (SE) 2009-05-20 EP disclosed
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US disclosed
WO-2008025798-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 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 (2 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-20080103123-A1 New compounds GPR119, GPR139, GPR180 LIPE 1938/4885ACHE 2534/4885GPR119 1/4885
US-20170129875-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST GPR119, FFAR2, GLP1R LIPE 495/4885ACHE 3961/4885GPR119 1/4885

“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.