SCHEMBL7276413

SCHEMBL7276413

CN1CCc2c(sc(C=O)c2Cl)C(c2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 14/20 0.51
DRD2 P14416 7/20 0.49
HSD17B10 Q99714 4/20 0.42
DRD5 P21918 3/20 0.42
CYP2D6 P10635 3/20 0.42
TSHR P16473 3/20 0.42
THPO P40225 3/20 0.42
CYP1A2 P05177 2/20 0.42
NFKB1 P19838 2/20 0.42
ALOX15 P16050 2/20 0.42
CYP3A4 P08684 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
LMNA P02545 1/20 0.41
ADRB2 P07550 1/20 0.41
GPR183 P32249 1/20 0.41
APLNR P35414 1/20 0.41
GLP1R P43220 1/20 0.41
CX3CR1 P49238 1/20 0.41

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
Hydrochloric Acid SCHEMBL7268604 0.99 DRD1 (0.53) DRD1DRD2HSD17B10DRD5CYP2D6
SCHEMBL7275785 0.84 DRD1 (0.41) DRD1DRD2HSD17B10DRD5CYP2D6
Hydrochloric Acid SCHEMBL7294530 0.83 DRD1 (0.58) DRD1DRD2HSD17B10DRD5CYP2D6
Hydrochloric Acid SCHEMBL7301244 0.81 DRD1 (0.57) DRD1DRD2HSD17B10DRD5CYP2D6
Hydrochloric Acid SCHEMBL7299250 0.81 DRD1 (0.56) DRD1DRD2HSD17B10DRD5CYP2D6
SCHEMBL7276967 0.80 DRD1 (0.53) DRD1DRD2HSD17B10DRD5CYP2D6
Hydrochloric Acid SCHEMBL7300699 0.79 DRD1 (0.55) DRD1DRD2HSD17B10DRD5CYP2D6
SCHEMBL7266679 0.79 DRD1 (0.54) DRD1DRD2HSD17B10DRD5CYP2D6
SCHEMBL7275194 0.78 DRD1 (0.53) DRD1DRD2HSD17B10DRD5CYP2D6
SCHEMBL7268165 0.77 DRD1 (0.45) DRD1DRD2HSD17B10DRD5CYP2D6

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-0324610-B1 Thieno[2,3-d]azepine derivatives, process for their preparation and pharmaceutical compositions containing them LILLY INDUSTRIES LTD (GB) 1994-04-13 EP disclosed
US-4904653-A Thieno[2,3-O]azepine compounds and CNS affecting use thereof LILLY INDUSTRIES LIMITED (GB) 1990-02-27 US disclosed
EP-0324610-A2 Thieno[2,3-d]azepine derivatives, process for their preparation and pharmaceutical compositions containing them LILLY INDUSTRIES LIMITED (GB) 1989-07-19 EP disclosed