SCHEMBL373589

SCHEMBL373589

CCN(CC)CCOc1ccc(OC2CCN(OC(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
GPR119 Q8TDV5 1/20 0.41
CHRM2 P08172 1/20 0.41
HRH3 Q9Y5N1 5/20 0.41
EBP Q15125 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
LSS P48449 1/20 0.40
LMNA P02545 1/20 0.40
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40

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
SCHEMBL973469 0.85 GPR119 (0.58) MAPTGPR119HRH3
SCHEMBL14795178 0.81 ACACB (0.49) GPR119
SCHEMBL3724395 0.80 GPR119 (0.46) MAPTGPR119CHRM2HRH3
SCHEMBL373517 0.80 GPR119 (0.46) GPR119CHRM2HRH3
SCHEMBL7308360 0.79 GPR119 (0.44) GPR119HRH3
SCHEMBL7301874 0.73 POLB (0.42) GPR119
SCHEMBL187570 0.72 ACKR3 (0.40) GPR119HRH3
SCHEMBL19624304 0.72 GPR119 (0.64) GPR119
SCHEMBL21023135 0.71 GPR119 (0.62) GPR119
SCHEMBL975277 0.71 EBP (0.49) MAPTCHRM2HRH3EBPSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2610258-B1 Substituted piperidino dihydrothieno pyrimidines BOEHRINGER INGELHEIM INT (DE) 2014-08-27 EP disclosed
EP-2380891-B1 Substituted piperidino-dihydrothienopyrimidines BOEHRINGER INGELHEIM INT (DE) 2013-12-11 EP disclosed
EP-2610258-A1 Substituted piperidino dihydrothieno pyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-07-03 EP disclosed
EP-2215092-B1 SUBSTITUTED PIPERIDINO-DIHYDROTHIENOPYRIMIDINES BOEHRINGER INGELHEIM INT (DE) 2012-01-25 EP disclosed
EP-2380891-A1 Substituted piperidino-dihydrothienopyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-10-26 EP disclosed
EP-2215092-A1 SUBSTITUTED PIPERIDINO-DIHYDROTHIENOPYRIMIDINES Boehringer Ingelheim International GmbH (DE) 2010-08-11 EP disclosed
WO-2009050248-A1 SUBSTITUTED PIPERIDINO-DIHYDROTHIENOPYRIMIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-23 WO disclosed