SCHEMBL11246015

SCHEMBL11246015

NCCN1C(=O)SC(c2ccc(Cl)c(Cl)c2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 9/20 0.37
SLC6A3 Q01959 9/20 0.37
KCNA5 P22460 1/20 0.34
SLC6A2 P23975 7/20 0.34
KCNH2 Q12809 5/20 0.34
CYP2D6 P10635 4/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
HTR2C P28335 2/20 0.33

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
Bromide SCHEMBL11273907 0.99 SLC6A4 (0.37) SLC6A4SLC6A3KCNA5SLC6A2KCNH2
SCHEMBL11282869 0.83 SLC6A3 (0.40) SLC6A4SLC6A3SLC6A2KCNH2CYP2D6
Bromide SCHEMBL11277120 0.77 CA2 (0.37) MAPT
SCHEMBL11252797 0.74 HTR2C (0.41) MAPTHTR2C
SCHEMBL11256784 0.66 ALDH1A1 (0.41) SLC6A4SLC6A3SLC6A2MAPT
SCHEMBL27014482 0.65 DRD2 (0.50) SLC6A4SLC6A3SLC6A2KCNH2CYP2D6
Hydrochloric Acid SCHEMBL11282109 0.59 CARM1 (0.44) TP53MAPT
SCHEMBL15828870 0.59 MAPT (0.52) TP53MAPT
SCHEMBL22411087 0.56 MAP2K1 (0.48) SLC6A4SLC6A3SLC6A2KCNH2CYP2D6
SCHEMBL9870878 0.56 SLC6A2 (0.58) SLC6A4SLC6A3SLC6A2KCNH2CYP2D6

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
EP-0002978-B1 THIAZOLIDINEDIONE-2,4 DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL APPLICATIONS SYNTHELABO (FR) 1982-10-06 EP claimed