SCHEMBL20537294

SCHEMBL20537294

CCCC=CC1CCCCN1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.36
SLC6A4 P31645 11/20 0.36
SLC6A3 Q01959 11/20 0.36
MEN1 O00255 2/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 2/20 0.32
KMT2A Q03164 2/20 0.32
MITF O75030 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NLRP1 Q9C000 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
CYP2D6 P10635 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 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
SCHEMBL18735782 0.89 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3MEN1LMNA
SCHEMBL14032382 0.84 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL27466565 0.82 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3MEN1LMNA
SCHEMBL9112814 0.78 CYP2D6 (0.30) SLC6A2SLC6A4SLC6A3MEN1LMNA
SCHEMBL25842227 0.78
SCHEMBL13560137 0.78
SCHEMBL27087454 0.78
SCHEMBL21533040 0.76
SCHEMBL5934908 0.74
SCHEMBL9114181 0.74

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
CN-108367943-B Water treatment method, related module and equipment 苏伊士集团 2023-01-24 CN disclosed
EP-3390283-A1 WATER TREATMENT METHOD, AND ASSOCIATED MODULE AND FACILITY SUEZ Groupe (FR) 2018-10-24 EP disclosed