SCHEMBL6987062

SCHEMBL6987062

c1ccc2c(c1)CCn1ccnc1C2

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.46
DRD1 P21728 8/20 0.46
DRD5 P21918 8/20 0.46
DRD4 P21917 6/20 0.46
DRD3 P35462 6/20 0.46
ADRA1A P35348 4/20 0.41
GRIN2D O15399 4/20 0.40
GRIN3B O60391 4/20 0.40
GRIN1 Q05586 4/20 0.40
GRIN2A Q12879 4/20 0.40
GRIN2B Q13224 4/20 0.40
GRIN2C Q14957 4/20 0.40
GRIN3A Q8TCU5 4/20 0.40
ADRA1D P25100 3/20 0.39
EED O75530 1/20 0.38
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
ADRA1B P35368 2/20 0.36
CHRM1 P11229 1/20 0.36

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
SCHEMBL6031009 0.88 TSHR (0.42) DRD2DRD1DRD5DRD4DRD3
SCHEMBL30561615 0.71 KDM4E (0.44) DRD2DRD3ADRA1AGRIN2DGRIN3B
SCHEMBL25779928 0.71 KDM4E (0.44) DRD2DRD3ADRA1AGRIN2DGRIN3B
SCHEMBL7136766 0.71 PDPK1 (0.47) DRD2DRD1DRD5DRD4DRD3
SCHEMBL19820931 0.68 DRD1 (0.50) DRD2DRD1DRD5DRD4DRD3
SCHEMBL4019735 0.67 HPGD (0.34) DRD1ADRA1AADRA1DADRA1B
SCHEMBL712267 0.66
SCHEMBL11707272 0.65 DRD2 (0.42) DRD2DRD1DRD5DRD4DRD3
SCHEMBL238844 0.65
SCHEMBL25043599 0.64 ADRA1A (0.37) DRD2DRD1DRD5DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0588858-B1 IMIDAZO 2,1-b] 3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA NV (BE) 2003-09-17 EP disclosed
CN-1142360-A A method for preparing a medical composition conpaining imidazo[2,1-b][3] benzo azepine dericvants YUAN ANLING (CN) 1997-02-12 CN disclosed
US-5468743-A Imidazo[2,1-b]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1995-11-21 US disclosed
EP-0588858-A1 IMIDAZO 2,1-b] 3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-30 EP disclosed
WO-1992022551-A1 IMIDAZO[2,1-b][3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-23 WO disclosed
EP-0518435-A1 Imidazo[2,1-b][3]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-16 EP disclosed