SCHEMBL11684135

SCHEMBL11684135

COc1ccc(NC(=S)Nc2cccc(NNC=O)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.60
CYP2C19 P33261 1/20 0.60
MAPT P10636 8/20 0.56
KMT2A Q03164 7/20 0.56
MEN1 O00255 4/20 0.56
IDO1 P14902 1/20 0.56
ALDH1A1 P00352 5/20 0.52
HTT P42858 1/20 0.52
GAA P10253 4/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAOA P21397 2/20 0.51
MAOB P27338 2/20 0.51
TP53 P04637 1/20 0.51
TSHR P16473 1/20 0.51
LMNA P02545 1/20 0.51
PPIA P62937 1/20 0.50
KDM4E B2RXH2 1/20 0.50
STAT1 P42224 1/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49

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
SCHEMBL11687936 0.89 CYP1A2 (0.61) CYP1A2CYP2C19MAPTKMT2AMEN1
SCHEMBL11242965 0.84 KMT2A (0.56) CYP1A2CYP2C19MAPTKMT2AMEN1
SCHEMBL11684076 0.82 ALDH1A1 (0.54) CYP1A2CYP2C19MAPTKMT2AMEN1
SCHEMBL11051368 0.78 SIRT1 (0.50) MAPTKMT2AMEN1ALDH1A1HTT
SCHEMBL11681216 0.77 ALDH1A1 (0.57) CYP1A2CYP2C19MAPTKMT2AMEN1
SCHEMBL10783773 0.77 MAPT (0.49) CYP1A2CYP2C19MAPTKMT2AMEN1
SCHEMBL9174022 0.77 ALDH1A1 (0.61) CYP1A2CYP2C19MAPTKMT2AMEN1
SCHEMBL1259295 0.76 CYP1A2 (1.00) CYP1A2CYP2C19MAPTKMT2AMEN1
SCHEMBL16566515 0.76 MEN1 (0.72) CYP1A2CYP2C19MAPTKMT2AMEN1
SCHEMBL6670522 0.76 RAB9A (0.52) MAPTIDO1ALDH1A1HTTGAA

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-4031127-A Acyl hydrazino thiourea derivatives as photographic nucleating agents EASTMAN KODAK COMPANY (US) 1977-06-21 US claimed