SCHEMBL7990176

SCHEMBL7990176

CC1SCN(CCCCN2CCN(c3coc4cc(F)ccc34)CC2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.45
HTR2A P28223 2/20 0.45
ADRA1B P35368 1/20 0.42
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39

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 0.77 DRD4 (0.39) DRD4HTR2AADRA1BDRD2DRD3
SCHEMBL7991398 0.76 DRD2 (0.41) ADRA1BDRD2DRD3
SCHEMBL8308708 0.74 HTR2A (0.37) DRD4HTR2ADRD2
SCHEMBL7996612 0.73 HTR1A (0.60) DRD4HTR2AADRA1BDRD2DRD3
SCHEMBL8307627 0.71 HTR1A (0.37) HTR2ADRD2
Oxalic Acid SCHEMBL7993398 0.69 KDM4E (0.63) DRD4DRD2DRD3
SCHEMBL15748300 0.69 DRD2 (0.53) DRD4DRD2DRD3
SCHEMBL10474213 0.68 HTR2A (0.55) DRD4HTR2AADRA1BDRD2
SCHEMBL8670431 0.67 DRD4 (0.35) DRD4HTR2ADRD2DRD3
SCHEMBL9759749 0.67 PARP1 (0.46) HTR2ADRD2DRD3

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
US-6284775-B1 PSYCHOLOGICAL DISORDERS AVENTIS PHARMACEUTICALS INC. 2001-09-04 US disclosed
US-5371087-A Antipsychotic, analgesics, anticonvulsant and anxiolytic agent HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-12-06 US disclosed
US-5229388-A 3-[4-(1-substituted-4-piperazinyl)butyl]-4-thiazolidinone and related compounds HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-07-20 US disclosed
US-5136037-A 3-(4-substituted-4-piperazinyl)butyl-4-thiazolidinone and related compounds HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1992-08-04 US disclosed
US-5037984-A Anticonvulsants; anxiolytic agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1991-08-06 US disclosed
US-4933453-A ANTIPSYCHOTIC, ANALGESIC, ANTICONVULSANT, AND ANXIOLYTIC AGENTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1990-06-12 US disclosed