SCHEMBL9725722

SCHEMBL9725722

C=CCSC(=O)N(CC=CCl)Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.37
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
REN P00797 2/20 0.36
MGLL Q99685 1/20 0.36
TSHR P16473 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SNCA P37840 1/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL9725641 0.81 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9725645 0.76 CYP3A4 (0.41) GAATDP1LMNAALDH1A1NPSR1
SCHEMBL10671522 0.73 TDP1 (0.42) TDP1LMNAALDH1A1NPSR1TSHR
SCHEMBL2531923 0.70 GAA (0.53) GAATDP1LMNAALDH1A1NPSR1
SCHEMBL295841 0.69 LMNA (0.53) GAATDP1LMNAALDH1A1NPSR1
SCHEMBL9725655 0.69
SCHEMBL11565920 0.69 GAA (0.49) GAATDP1LMNAALDH1A1NPSR1
SCHEMBL11642504 0.68 GRIN2D (0.42) GAATDP1LMNAALDH1A1L3MBTL1
SCHEMBL9725653 0.68 FFAR1 (0.35) TDP1LMNAALDH1A1NPSR1MAPT
SCHEMBL5932371 0.67 GAA (0.50) GAATDP1LMNAALDH1A1NPSR1

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
US-5171356-A Thiolcarbamate and nonphytotoxic extender which minimizes soil degradation ICI AMERICAS INC. (US) 1992-12-15 US claimed