SCHEMBL8346604

SCHEMBL8346604

OC(CCc1noc2cc(F)ccc12)CN1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.49
DRD2 P14416 11/20 0.47
HTR2A P28223 11/20 0.47
HTR7 P34969 10/20 0.47
HTR6 P50406 10/20 0.47
HSF1 Q00613 2/20 0.43
HTR1A P08908 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
SCHEMBL8712202 0.80 DRD2 (0.43) ACHEDRD2HTR2AHTR7HTR6
SCHEMBL10634163 0.80 ACHE (0.60) ACHEDRD2HTR2AHTR7HTR6
SCHEMBL8347373 0.80 DRD2 (0.47) ACHEDRD2HTR2AHTR7HTR6
Hydrochloric Acid SCHEMBL10638219 0.79 ACHE (0.59) ACHEDRD2HTR2AHTR7HTR6
Oxalic Acid SCHEMBL10637290 0.76 DRD2 (0.56) ACHEDRD2HTR2AHTR7HTR6
SCHEMBL8346976 0.76 ACHE (0.47) ACHEDRD2HTR2AHTR7HTR6
Oxalic Acid SCHEMBL10634863 0.75 HTR2A (0.56) ACHEDRD2HTR2AHTR7HTR6
SCHEMBL8351462 0.75 DRD2 (0.47) ACHEDRD2HTR2AHTR7HTR6
SCHEMBL5364371 0.74 ATM (0.55) DRD2HTR2AHTR1A
SCHEMBL5364377 0.74 ATM (0.55) DRD2HTR2AHTR1A

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5919798-A USEFUL AS ANTIPSYCHOTIC AND ANALGESIC AGENTS. HOECHST MARION ROUSSEL, INC. (US) 1999-07-06 US disclosed
US-5889035-A 1-(Arylthioalkyl, arylaminoalkyl or arylmethylenealkyl)-3-(heteroaryl) pyrrolidines and related compounds useful as antipsychotics and analgesics HOECHST MARION ROUSSEL, INC. (US) 1999-03-30 US disclosed
US-5889004-A PSYCHOLOGICAL DISORDERS, ANALGESICS HOECHST MARION ROUSSEL, INC. (US) 1999-03-30 US disclosed
US-5874435-A PSYCHOLOGICAL DISORDERS; ANALGESICS HOECHST MARION ROUSSEL, INC. (US) 1999-02-23 US disclosed
US-5854243-A 3-heteroaryl-1-pyrrolidinealkylthiols and derivatives thereof and their therapeutic utility HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1998-12-29 US disclosed
US-5854263-A 1- (1,4-benzodioxanyl)alkyl!-3-(heteroaryl) pyrrolidines and related compounds and their therapeutic utility HOECHST MARION ROUSSEL, INC. (US) 1998-12-29 US disclosed
US-5843977-A (3-heteroaryl-1-pyrrolidinyl) alkoxy!-3,4-dihydro-1(2H)-naphthalenones and related compounds and their therapeutic utility HOECHST MARION ROSUEEL, INC. 1998-12-01 US disclosed
US-5843949-A 1-(1H-indolyloxyalkyl)-4-(heteroaryl)piperazines and related compounds useful as antipsychotics and analgesics HOECHST MARION ROUSSEL, INC. 1998-12-01 US disclosed
US-5840727-A ANTIPSYCHOTICS, ANALGESICS AVENTIS PHARMACEUTICALS INC. 1998-11-24 US disclosed
US-5811430-A 1 (2-pyrimidinyloxy) alkyl!-4- (heteroaryl) Piperidines and related compounds and their therapeutic utility HOECHST MARION ROUSSEL, INC. 1998-09-22 US disclosed
US-5811435-A 2- (4-heteroaryl-1-piperidinyl)alkyl!-1,3-dioxanes and related compounds and their therapeutic utility HOECHST MARION RUSSEL, INC. 1998-09-22 US disclosed