SCHEMBL28848119

SCHEMBL28848119

CCCCCCCCCCC(CCCCCCCC)Cc1ccsc1.[SnH2]

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.40
DRD3 P35462 2/20 0.40
CSNK1E P49674 1/20 0.39
LMNA P02545 1/20 0.37
MME P08473 3/20 0.36
TAAR1 Q96RJ0 1/20 0.35
BDKRB2 P30411 4/20 0.34
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
SLC1A3 P43003 2/20 0.32
SLC1A2 P43004 2/20 0.32
SLC1A1 P43005 2/20 0.32

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
SCHEMBL1436621 0.98 DRD2 (0.41) DRD2DRD3CSNK1ELMNAMME
SCHEMBL28293353 0.98 DRD2 (0.41) DRD2DRD3CSNK1ELMNAMME
SCHEMBL28293348 0.98 DRD2 (0.41) DRD2DRD3CSNK1ELMNAMME
SCHEMBL19150729 0.98 DRD2 (0.41) DRD2DRD3CSNK1ELMNAMME
SCHEMBL18750434 0.98 DRD2 (0.41) DRD2DRD3CSNK1ELMNAMME
SCHEMBL28738370 0.98 DRD2 (0.41) DRD2DRD3CSNK1ELMNAMME
SCHEMBL20972395 0.98 DRD2 (0.41) DRD2DRD3CSNK1ELMNAMME
SCHEMBL2570906 0.98 DRD2 (0.41) DRD2DRD3CSNK1ELMNAMME
SCHEMBL19824796 0.97 DRD2 (0.40) DRD2DRD3CSNK1ELMNAMME
SCHEMBL19799296 0.92 DRD2 (0.39) DRD2DRD3CSNK1ELMNAMME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107057044-A Heteroatom-substituted benzothiadiazole-based polymer donor material and preparation method and application thereof 南方科技大学 2017-08-18 CN disclosed