SCHEMBL6776029

SCHEMBL6776029

CO[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1CNCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.48
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
STS P08842 1/20 0.48
KDM4E B2RXH2 1/20 0.48
PKM P14618 1/20 0.48
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
LMNA P02545 1/20 0.46
ACHE P22303 1/20 0.46
TACR1 P25103 1/20 0.44
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TP53 P04637 2/20 0.44
USP30 Q70CQ3 3/20 0.44
BCHE P06276 1/20 0.44
HTR6 P50406 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
YAP1 P46937 1/20 0.43

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
SCHEMBL6776034 1.00 GPR119 (0.48) GPR119JAK2JAK1STSKDM4E
SCHEMBL856875 0.88 KDM4E (0.51) GPR119JAK2JAK1STSKDM4E
SCHEMBL505521 0.88 KDM4E (0.51) GPR119JAK2JAK1STSKDM4E
SCHEMBL8193065 0.84 PPARG (0.41) JAK2JAK1GAASMN1; SMN2
SCHEMBL2852962 0.83 GPR119 (0.50) GPR119JAK2JAK1STSKDM4E
SCHEMBL2852965 0.83 GPR119 (0.50) GPR119JAK2JAK1STSKDM4E
SCHEMBL7985552 0.82 KDM4E (0.69) GPR119STSKDM4EPKMKEAP1
SCHEMBL23545669 0.82 EPHX1 (0.42) GPR119JAK2JAK1KDM4EPKM
SCHEMBL30716269 0.81 JAK2 (0.58) GPR119JAK2JAK1STSKDM4E
SCHEMBL21725308 0.80 NAMPT (0.48) GPR119JAK2JAK1STSKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6750349-B2 SUPERIOR GASTROKINETIC PROPERTIES JANSSEN PHARMACEUTICS, N.V. (BE) 2004-06-15 US disclosed
EP-1000028-B1 GASTROKINETIC MONOCYCLIC BENZAMIDES OF 3- OR 4-SUBSTITUTED 4-(AMINOMETHYL)-PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-11-26 EP disclosed
US-20030078427-A1 Monocyclic benzamides of 3- or 4-substituted 4-(aminomethyl)-piperidine derivatives BOSMANS JEAN-PAUL RENE MARIE A (BE) 2003-04-24 US disclosed
EP-1000028-A1 GASTROKINETIC MONOCYCLIC BENZAMIDES OF 3- OR 4-SUBSTITUTED 4-(AMINOMETHYL)-PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2000-05-17 EP disclosed
WO-1999002494-A1 GASTROKINETIC MONOCYCLIC BENZAMIDES OF 3- OR 4-SUBSTITUTED 4-(AMINOMETHYL)-PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1999-01-21 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-20030078427-A1 Monocyclic benzamides of 3- or 4-substituted 4-(aminomethyl)-piperidine derivatives HRH2, ALK, CBR1 GPR119 284/4885JAK2 1891/4885JAK1 2655/4885

“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.