SCHEMBL7175661

SCHEMBL7175661

CN1CCC(C2(O)c3sccc3CCn3ccnc32)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
DRD2 P14416 2/20 0.34
DRD1 P21728 2/20 0.34
DRD4 P21917 2/20 0.34
DRD5 P21918 2/20 0.34
DRD3 P35462 2/20 0.34
OPRL1 P41146 2/20 0.33

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
SCHEMBL7143137 0.84 L3MBTL1 (0.45) MAPK1SMN1; SMN2L3MBTL1DRD2DRD1
SCHEMBL8248389 0.83 MAPK1 (0.40) MAPK1SMN1; SMN2L3MBTL1DRD2DRD1
SCHEMBL8931326 0.76 L3MBTL1 (0.38) MAPK1SMN1; SMN2L3MBTL1
SCHEMBL7140698 0.74 SMN1; SMN2 (0.42) MAPK1SMN1; SMN2L3MBTL1
SCHEMBL7145443 0.70 MAPK1 (0.39) MAPK1SMN1; SMN2L3MBTL1
SCHEMBL9258828 0.70 L3MBTL1 (0.43) MAPK1SMN1; SMN2L3MBTL1
SCHEMBL7172954 0.69 DRD2 (0.35) SMN1; SMN2DRD2DRD1DRD4DRD5
SCHEMBL8931639 0.65 L3MBTL1 (0.38) MAPK1SMN1; SMN2L3MBTL1
SCHEMBL6987999 0.64 MAPK1 (0.48) MAPK1SMN1; SMN2L3MBTL1
SCHEMBL8207630 0.63 L3MBTL1 (0.43) MAPK1SMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672047-B1 ANTIALLERGIC IMIDAZO[1,2-a]THIENO[ 2,3-d]AZEPINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-05-02 EP disclosed
US-5629308-A Imidazo [1,2-A] (pyrrolo, thieno or furano) [2,3-D] azepine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1997-05-13 US disclosed
EP-0672047-A1 ANTIALLERGIC IMIDAZO 1,2-a](PYRROLO, THIENO OR FURANO) 2,3-d]AZEPINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1995-09-20 EP disclosed
WO-1994013680-A1 ANTIALLERGIC IMIDAZO[1,2-a](PYRROLO, THIENO OR FURANO)[2,3-d]AZEPINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1994-06-23 WO disclosed