SCHEMBL6923759

SCHEMBL6923759

CCCN1CCCN(C(=O)c2cccc(NS(=O)(=O)c3cccc(Cl)c3)c2)CC1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
ALDH1A1 P00352 5/20 0.56
LMNA P02545 3/20 0.56
PKM P14618 1/20 0.53
RAB9A P51151 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HSD11B1 P28845 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL6922338 0.95 POLB (0.56) POLBALDH1A1LMNAPKMRAB9A
SCHEMBL6827973 0.89 PKM (0.61) POLBALDH1A1LMNAPKMRAB9A
SCHEMBL6926084 0.86 POLB (0.56) POLBALDH1A1LMNAPKMRAB9A
SCHEMBL6923737 0.86 POLB (0.52) POLBALDH1A1LMNAPKMRAB9A
SCHEMBL6922336 0.85 ALDH1A1 (0.56) POLBALDH1A1LMNAPKMRAB9A
SCHEMBL6927936 0.85 ALDH1A1 (0.56) POLBALDH1A1LMNAPKMRAB9A
SCHEMBL6929296 0.85 ALDH1A1 (0.58) POLBALDH1A1LMNAPKMRAB9A
SCHEMBL3069679 0.85 ALDH1A1 (0.54) POLBALDH1A1LMNAPKMRAB9A
SCHEMBL6831335 0.84 ALDH1A1 (0.67) POLBALDH1A1LMNAPKMSMN1; SMN2
SCHEMBL3075154 0.84 PKM (0.59) POLBALDH1A1LMNAPKMRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004073619-A2 CCR8 ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2004-09-02 WO claimed
WO-2004073619-A2 CCR8 ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2004-09-02 WO disclosed