SCHEMBL10694774

SCHEMBL10694774

CN1CCc2cc(Cl)c(O)cc2C(c2ccsc2)C1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 11/20 0.72
DRD2 P14416 5/20 0.72
DRD5 P21918 4/20 0.72
HSD17B10 Q99714 3/20 0.72
CYP1A2 P05177 2/20 0.72
CYP2D6 P10635 2/20 0.72
TSHR P16473 2/20 0.72
THPO P40225 2/20 0.72
CYP3A4 P08684 1/20 0.72
NFKB1 P19838 1/20 0.72
MEN1 O00255 1/20 0.72
ALOX15 P16050 1/20 0.72
KMT2A Q03164 1/20 0.72
SIGMAR1 Q99720 1/20 0.72
LMNA P02545 1/20 0.71
ADRB2 P07550 1/20 0.71
GPR183 P32249 1/20 0.71
APLNR P35414 1/20 0.71
GLP1R P43220 1/20 0.71
CX3CR1 P49238 1/20 0.71

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
Sch-23390 SCHEMBL11107859 0.84 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2
Sch-23390 SCHEMBL5722114 0.84 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2
Sch-23390 SCHEMBL29431888 0.84 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2
Sch-23390 SCHEMBL2916216 0.84 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2
Sch-23390 SCHEMBL16187032 0.84 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2
Sch-23390 SCHEMBL29424268 0.84 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2
Sch-23390 SCHEMBL30628012 0.84 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2
Sch-23390 SCHEMBL29797998 0.84 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2
SCHEMBL10691596 0.84 CYP2D6 (0.59) DRD1DRD2DRD5HSD17B10CYP1A2
Sch-23390 SCHEMBL1774186 0.83 DRD1 (1.00) DRD1DRD2DRD5HSD17B10CYP1A2

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
US-4751222-A 2,3,4,5-tetrahydro-1H-3-benzazepines and CNS affecting use thereof NOVO INDUSTRI A/S (DK) 1988-06-14 US disclosed
EP-0200455-A2 2,3,4,5-tetrahydro-1H-3-benzazepines substituted in position 5 NOVO NORDISK A/S (DK) 1986-11-05 EP disclosed