SCHEMBL8303565

SCHEMBL8303565

CC1SCN(CCCCC2CNCCN2c2n[nH]c3cc(F)ccc23)C1=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 5/20 0.34
SLC6A2 P23975 5/20 0.34
SLC6A4 P31645 5/20 0.34
SLC6A3 Q01959 5/20 0.34
HTR2A P28223 1/20 0.32
PLK1 P53350 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
SCHEMBL8303832 0.81 DRD4 (0.39) HTR2A
SCHEMBL8303726 0.68 HTR2A (0.38) CYP2D6SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL9759749 0.68 PARP1 (0.46) SLC6A2SLC6A4SLC6A3HTR2A
SCHEMBL8308708 0.64 HTR2A (0.37) HTR2A
SCHEMBL8307627 0.63 HTR1A (0.37) HTR2A
SCHEMBL8302347 0.63 DRD4 (0.43) HTR2A
SCHEMBL1545481 0.62 HTR2A (0.47) HTR2A
Hydrochloric Acid SCHEMBL3896963 0.61 HTR2A (0.46) HTR2A
Hydrochloric Acid SCHEMBL1545694 0.61 HTR2A (0.46) HTR2A
SCHEMBL8304798 0.60 DRD4 (0.44) HTR2A

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-0458234-B1 3-[1,Thiazolidinylbutyl-4-piperazinyl]-1H-indazoles, a process for their preparation and their use as medicaments HOECHST MARION ROUSSEL INC (US) 1999-03-31 EP disclosed
EP-0458234-A2 3-[1,Thiazolidinylbutyl-4-piperazinyl]-1H-indazoles, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-11-27 EP disclosed
US-5041445-A Antipsychotic agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-08-20 US disclosed