SCHEMBL8431968

SCHEMBL8431968

CC1CCc2ccsc2C1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.51
DRD3 P35462 5/20 0.51
GRIN2B Q13224 10/20 0.41
PDK1 Q15118 1/20 0.37
DRD1 P21728 1/20 0.37
DRD4 P21917 1/20 0.37
DRD5 P21918 1/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PNMT P11086 1/20 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
SCHEMBL15829307 0.83 DRD2 (0.51) DRD2DRD3GRIN2BMEN1NPC1
SCHEMBL15576825 0.80
SCHEMBL5951123 0.75 DRD2 (0.47) DRD2DRD3GRIN2BDRD1DRD4
SCHEMBL9414968 0.75 PLAU (0.50) DRD2DRD3GRIN2B
SCHEMBL5447410 0.75 DRD2 (0.51) DRD2DRD3GRIN2BDRD1DRD4
SCHEMBL25086353 0.75 DRD2 (0.47) DRD2DRD3GRIN2BMEN1NPC1
SCHEMBL31563873 0.75 DRD2 (0.47) DRD2DRD3GRIN2BDRD1DRD4
Hydrochloric Acid SCHEMBL8715553 0.73 PLAU (0.48) DRD2DRD3GRIN2B
Hydrochloric Acid SCHEMBL31564363 0.73 DRD2 (0.62) DRD2DRD3GRIN2BDRD1DRD4
Hydrochloric Acid SCHEMBL31564416 0.73 DRD2 (0.46) DRD2DRD3GRIN2BDRD1DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5985062-A EXTRUDING MULTILAYER TUBULAR STRUCTURE COMPRISING INTERNAL SEMICONDUCTIVE LAYER, INTERMEDIATE FIELD-CONTROL LAYER, EXTERNAL INSULATIVE LAYER, CUTTING TO DESIRED LENGTH, PARTIALLY REMOVING SEMICONDUCTOR LAYER TO PROVIDE ELECTRODE PIRELLI CAVI S.P.A. (IT) 1999-11-16 US claimed
EP-0683557-A1 Production process for elastomer sleeves for covering electric cable joints and associated sleeve PIRELLI CAVI S.p.A. (IT) 1995-11-22 EP claimed
WO-2021212010-A2 SMALL MOLECULE ANTIVIRAL DRUG TREATMENT FOR HUMAN PAPILLOMAVIRUS INFECTIONS THE TRUSTEES OF INDIANA UNIVERSITY (US) 2021-10-21 WO disclosed
WO-2021115375-A1 NITROGEN-CONTAINING HETEROCYCLIC AUTOTAXIN INHIBITOR, AND COMPOSITION CONTAINING SAME AND USE THEREOF 四川海思科制药有限公司 2021-06-17 WO disclosed
EP-0683557-A1 Production process for elastomer sleeves for covering electric cable joints and associated sleeve PIRELLI CAVI S.p.A. (IT) 1995-11-22 EP disclosed