SCHEMBL7993160

SCHEMBL7993160

CC1SC(C)(C)C(=O)N1CCCCN1CCN(c2ncc(F)cn2)CC1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 2/20 0.59
HTR2A P28223 2/20 0.59
HTR1A P08908 3/20 0.58
SIGMAR1 Q99720 5/20 0.49

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
SCHEMBL7990522 0.86 DRD4 (0.61) DRD4HTR2AHTR1ASIGMAR1
SCHEMBL7991554 0.78 HTR1A (0.60) HTR1ASIGMAR1
SCHEMBL8307680 0.76 HTR2A (0.65) DRD4HTR2A
SCHEMBL7679404 0.74 DRD4 (1.00) DRD4HTR2A
SCHEMBL9298831 0.74 DRD4 (0.54) DRD4HTR2A
SCHEMBL13532482 0.74 HTR1A (1.00) HTR2AHTR1ASIGMAR1
SCHEMBL7991258 0.73 HTR2A (0.55) DRD4HTR2AHTR1A
Hydrochloric Acid SCHEMBL11172469 0.73 HTR1A (0.98) HTR2AHTR1ASIGMAR1
SCHEMBL9760169 0.72 HTR2A (0.52) DRD4HTR2AHTR1A
SCHEMBL7993630 0.72 HTR1A (0.58) HTR2AHTR1A

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