SCHEMBL3349865

SCHEMBL3349865

N#Cc1ccc(-c2ccc(OC3CCN(C(=O)O)CC3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.59
GPR119 Q8TDV5 1/20 0.59
EPHX2 P34913 3/20 0.52
MLNR O43193 1/20 0.49
PRKAA2 P54646 2/20 0.46
MMP2 P08253 1/20 0.46
FPR2 P25090 1/20 0.45
PROKR1 Q8TCW9 1/20 0.45
PRKAB2 O43741 1/20 0.45
CYP3A4 P08684 1/20 0.45
PRKAG1 P54619 1/20 0.45
PRKAA1 Q13131 1/20 0.45
PRKAG3 Q9UGI9 1/20 0.45
PRKAG2 Q9UGJ0 1/20 0.45
PRKAB1 Q9Y478 1/20 0.45

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
SCHEMBL3290157 0.96 HRH3 (0.64) HRH3GPR119EPHX2MLNRPRKAA2
SCHEMBL14634278 0.91 GPR119 (0.71) HRH3GPR119EPHX2MLNRPRKAA2
SCHEMBL14634277 0.91 GPR119 (0.71) HRH3GPR119EPHX2MLNRPRKAA2
SCHEMBL19901156 0.88 HRH3 (0.62) HRH3GPR119EPHX2MLNRFPR2
SCHEMBL21824807 0.88 HRH3 (0.61) HRH3GPR119EPHX2MLNRPRKAA2
SCHEMBL18318284 0.87 HRH3 (0.57) HRH3GPR119EPHX2MLNR
SCHEMBL22173961 0.86 HRH3 (0.56) HRH3GPR119EPHX2MLNR
SCHEMBL18318099 0.85 HRH3 (0.61) HRH3GPR119EPHX2MLNRFPR2
SCHEMBL18318320 0.85 HRH3 (0.62) HRH3GPR119EPHX2MLNRFPR2
SCHEMBL227404 0.83 HRH3 (0.67) HRH3GPR119EPHX2MLNRPRKAA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3310441-B1 1, 4-SUBSTITUTED PIPERIDINE DERIVATIVES 89BIO LTD (IL) 2020-07-29 EP claimed
WO-2010048149-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2010-04-29 WO disclosed