SCHEMBL10364685

SCHEMBL10364685

N#CN1CCC(c2nsc3ccccc23)CC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.49
DRD4 P21917 1/20 0.49
DRD3 P35462 1/20 0.49
GRM2 Q14416 1/20 0.49
HTR1A P08908 1/20 0.44
HTR2A P28223 1/20 0.44
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
USP30 Q70CQ3 8/20 0.37
ALDH1A1 P00352 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ACHE P22303 2/20 0.36

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
SCHEMBL10985997 0.82 DRD2 (0.55) DRD2DRD4DRD3GRM2HTR1A
SCHEMBL10991961 0.81 DRD2 (0.52) DRD2DRD4DRD3GRM2HTR1A
SCHEMBL1840347 0.81 DRD2 (0.58) DRD2DRD4DRD3GRM2HTR1A
Bromide SCHEMBL10365464 0.79 DRD2 (0.57) DRD2DRD4DRD3GRM2HTR1A
Hydrochloric Acid SCHEMBL1836699 0.79 DRD2 (0.57) DRD2DRD4DRD3GRM2HTR1A
SCHEMBL10364952 0.76 DRD2 (0.57) DRD2DRD4DRD3GRM2HTR1A
SCHEMBL2204018 0.75 DRD2 (0.46) DRD2DRD4DRD3GRM2HTR1A
SCHEMBL10987775 0.75 GRM4 (0.55) DRD2DRD4DRD3GRM2HTR1A
Bromide SCHEMBL10365633 0.75 DRD2 (0.56) DRD2DRD4DRD3GRM2HTR1A
SCHEMBL10505910 0.75 DRD2 (0.47) DRD2DRD4DRD3GRM2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4458076-A ANALGESICS, ANTIPSYCHOTICS HOECHST-ROUSSEL PHARMACEUTICALS (US) 1984-07-03 US claimed
EP-0127167-B1 3-(4-PIPERIDINYL)-1,2-BENZISOTHIAZOLES AND DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1990-04-04 EP disclosed
EP-0159666-B1 ANTIHYPERTENSIVE 1,2-BENZISOTHIAZOLE PIPERIDINES, A METHOD FOR SYNTHESIZING THE SAME AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-06-14 EP disclosed
US-4558056-A PSYCHOLOGICAL DISORDERS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-12-10 US disclosed
EP-0159666-A2 Antihypertensive 1,2-Benzisothiazole Piperidines, a method for synthesizing the same and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1985-10-30 EP disclosed
US-4528292-A Antihypertensive 1,2-benzisothiazole piperidines HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-07-09 US disclosed
US-4524074-A TREATMENT OF PSYCHOSES HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-06-18 US disclosed
EP-0127167-A2 3-(4-Piperidinyl)-1,2-benzisothiazoles and derivatives, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1984-12-05 EP disclosed
US-4458076-A ANALGESICS, ANTIPSYCHOTICS HOECHST-ROUSSEL PHARMACEUTICALS (US) 1984-07-03 US disclosed