SCHEMBL28298714

SCHEMBL28298714

Cc1csc(NC(=O)NC2CC2(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 1/20 0.41
GAA P10253 5/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
GFER P55789 2/20 0.36
RAB9A P51151 1/20 0.36
DAO P14920 1/20 0.34
TP53 P04637 3/20 0.33
MAPT P10636 5/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HDAC3 O15379 2/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
ALOX12 P18054 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL28300152 0.84 RAB9A (0.41) RAF1GAAALDH1A1HPGDGFER
SCHEMBL28873510 0.80 RAB9A (0.55) RAF1GAAALDH1A1HPGDGFER
SCHEMBL28300136 0.80 RAB9A (0.40) RAF1GAAALDH1A1HPGDGFER
SCHEMBL28298682 0.78 ALDH1A1 (0.56) GAAALDH1A1HPGDGFERRAB9A
SCHEMBL28300209 0.74 RAF1 (0.45) RAF1GAAALDH1A1HPGDGFER
SCHEMBL28300137 0.73 RAF1 (0.39) RAF1GAAALDH1A1HPGDGFER
SCHEMBL28300148 0.73 RAF1 (0.42) RAF1GAAALDH1A1HPGDGFER
SCHEMBL1694410 0.71 DAO (0.52) RAF1GAARAB9ADAOTP53
SCHEMBL28196767 0.70 GAA (0.54) RAF1GAAALDH1A1DAOTP53
SCHEMBL28196751 0.70 RAF1 (0.46) RAF1GAAALDH1A1RAB9ADAO

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
CN-109963858-A N3The thieno uracil and application thereof that ring-type replaces 拜耳股份公司 2019-07-02 CN disclosed