SCHEMBL11596184

SCHEMBL11596184

CC(=S)C(C)Nc1c(C)cccc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 2/20 0.39
RECQL P46063 1/20 0.39
GAA P10253 4/20 0.39
LMNA P02545 1/20 0.39
ATM Q13315 2/20 0.38
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPK1 P28482 1/20 0.36
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
NLRP3 Q96P20 1/20 0.34

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
SCHEMBL11597963 0.85 ALDH1A1 (0.48) ALOX12POLBALDH1A1MAPTSMN1; SMN2
SCHEMBL11245214 0.80 ATM (0.42) GAALMNAATMPOLBL3MBTL1
SCHEMBL6264012 0.76 POLB (0.43) LMNAATMPOLBL3MBTL1ALDH1A1
SCHEMBL1900149 0.76 POLB (0.43) LMNAATMPOLBL3MBTL1ALDH1A1
SCHEMBL4411485 0.76 POLB (0.43) LMNAATMPOLBL3MBTL1ALDH1A1
SCHEMBL4411484 0.76 POLB (0.43) LMNAATMPOLBL3MBTL1ALDH1A1
SCHEMBL14809396 0.74 DRD2 (0.45) LMNAATMPOLBL3MBTL1ALDH1A1
Hydrochloric Acid SCHEMBL14988824 0.74 POLB (0.42) GAALMNAATMPOLBL3MBTL1
SCHEMBL1004808 0.74 ALDH1A1 (0.40) ALOX12RECQLLMNAATMPOLB
SCHEMBL11174052 0.73 CYP1A2 (0.39) LMNAATMPOLBL3MBTL1ALDH1A1

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-4101672-A FUNGICIDES CIBA-GEIGY CORPORATION (US) 1978-07-18 US disclosed