SCHEMBL8353183

SCHEMBL8353183

Fc1ccc2c(C3CC[N]CC3)n[nH]c2c1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 15/20 0.45
MAP2K7 O14733 3/20 0.41
MAPK1 P28482 2/20 0.41
MAPK6 Q16659 2/20 0.41
HTR2A P28223 2/20 0.41
MAPKAPK2 P49137 1/20 0.41
MAPKAPK3 Q16644 1/20 0.41
ITK Q08881 1/20 0.39
RBP4 P02753 1/20 0.38

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
SCHEMBL1545411 0.85 HTR2A (0.47) MAP2K4MAP2K7MAPK1MAPK6HTR2A
SCHEMBL29688637 0.85 HTR2A (0.47) MAP2K4MAP2K7MAPK1MAPK6HTR2A
Hydrochloric Acid SCHEMBL8916894 0.84 HTR2A (0.46) MAP2K4MAP2K7MAPK1MAPK6HTR2A
Hydrochloric Acid SCHEMBL7227155 0.84 HTR2A (0.46) MAP2K4MAP2K7MAPK1MAPK6HTR2A
SCHEMBL8469395 0.82 PDPK1 (0.50) HTR2A
SCHEMBL10395740 0.81 HTR2A (0.50) MAP2K4HTR2ARBP4
SCHEMBL8209600 0.79 MAP2K4 (0.43) MAP2K4MAP2K7MAPK1MAPK6HTR2A
Hydrochloric Acid SCHEMBL9429130 0.78 MAP2K4 (0.42) MAP2K4MAP2K7MAPK1MAPK6HTR2A
SCHEMBL10396662 0.78 RBP4 (0.45) MAP2K4MAP2K7MAPK1MAPK6HTR2A
SCHEMBL9830318 0.78 RBP4 (0.41) MAP2K4MAP2K7MAPK1MAPK6HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US claimed
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
US-5776963-A ANTIPSYCHOTIC AGENTS HOECHST MARION ROUSSEL, INC. (US) 1998-07-07 US disclosed
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed