SCHEMBL4966607

SCHEMBL4966607

O=C(O)Oc1cc2n(c1)CCCC2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.33
MEN1 O00255 3/20 0.33
ALDH1A1 P00352 3/20 0.33
NPC1 O15118 2/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
ESR1 P03372 1/20 0.32
PGR P06401 1/20 0.32
CHRM2 P08172 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
AR P10275 1/20 0.32
CHRM1 P11229 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A3 Q01959 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL1393022 0.75 ALDH1A1 (0.39) KMT2AMEN1ALDH1A1POLBSMN1; SMN2
SCHEMBL21570231 0.71 ALDH1A1 (0.37) KMT2AMEN1ALDH1A1POLBSMN1; SMN2
SCHEMBL20346931 0.70 ATM (0.38) ALDH1A1NPC1TSHRSMN1; SMN2MAPT
SCHEMBL25318763 0.67 RAB9A (0.45) KMT2AMEN1ALDH1A1NPC1SMN1; SMN2
SCHEMBL22279544 0.67 MAPT (0.42) KMT2AMEN1ALDH1A1POLBTSHR
SCHEMBL14704043 0.66 DRD3 (0.39) KMT2AMEN1ALDH1A1NPC1MAPT
SCHEMBL13394781 0.64 DRD3 (0.38) KMT2AMEN1ALDH1A1POLBSMN1; SMN2
SCHEMBL21570233 0.64 SMN1; SMN2 (0.41) KMT2AALDH1A1NPC1POLBTSHR
SCHEMBL942185 0.64 LMNA (0.33) KMT2AMEN1ALDH1A1MAPTHTT
SCHEMBL17360810 0.63 PGR (0.40) KMT2AMEN1TSHRSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778685-B1 INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF SANOL ARZNEI SCHWARZ GMBH (DE) 2008-03-26 EP disclosed
EP-1778685-A1 INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF SCHWARZ PHARMA AG (DE) 2007-05-02 EP disclosed
WO-2006015737-A1 INDOLIZINE CARBOXAMIDES AND THE AZA AND DIAZA DERIVATIVES THEREOF SCHWARZ PHARMA AG (DE) 2006-02-16 WO disclosed