SCHEMBL11292167

SCHEMBL11292167

CC(C)NC(=S)C(=S)NSc1cccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.41
ALDH1A1 P00352 5/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
LTC4S Q16873 2/20 0.39
IFNAR1 P17181 1/20 0.36
GAA P10253 1/20 0.35
NCEH1 Q6PIU2 1/20 0.35
ADRB2 P07550 4/20 0.33
ADRB1 P08588 4/20 0.33
CYP2D6 P10635 4/20 0.33
ADRB3 P13945 3/20 0.33
CYP1A2 P05177 3/20 0.33
SLC6A4 P31645 3/20 0.33
HTR2B P41595 3/20 0.33
SIGMAR1 Q99720 3/20 0.33
NR2E1 Q9Y466 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTR1B P28222 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
SCHEMBL11292168 0.87 LMNA (0.43) LMNAALDH1A1MEN1HPGDKMT2A
SCHEMBL11766853 0.71 LMNA (0.46) LMNAALDH1A1MEN1HPGDKMT2A
SCHEMBL11292166 0.71 LMNA (0.38) LMNAALDH1A1MEN1HPGDKMT2A
SCHEMBL27475467 0.68 GAA (0.53) LMNAALDH1A1MEN1KMT2AIFNAR1
SCHEMBL5448135 0.66 LMNA (0.69) LMNAALDH1A1MEN1KMT2AGAA
SCHEMBL9342243 0.65 CYP1A2 (0.45) LMNAALDH1A1IFNAR1ADRB2ADRB1
SCHEMBL7265932 0.64 IFNAR1 (0.43) LMNAALDH1A1HPGDIFNAR1GAA
SCHEMBL2116696 0.64 IFNAR1 (0.43) LMNAALDH1A1HPGDIFNAR1CYP1A2
SCHEMBL8474345 0.64 IFNAR1 (0.47) LMNAALDH1A1HPGDIFNAR1CYP2D6
SCHEMBL18217960 0.63 IFNAR1 (0.42) LMNAALDH1A1MEN1HPGDKMT2A

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-4311647-A Process for preparation of (hydrocarbonthio)oxamides THE B. F. GOODRICH COMPANY (US) 1982-01-19 US disclosed