SCHEMBL28310232

SCHEMBL28310232

Cc1ccc(C(=O)CNC[C]=O)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
GAA P10253 2/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
NR1H4 Q96RI1 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
AGTR1 P30556 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL28309485 0.81 CES2 (0.47) MAPTGAALMNAKMT2AMEN1
SCHEMBL11396201 0.79 KMT2A (0.47) MAPTGAALMNAKMT2AMEN1
SCHEMBL13622409 0.78 LMNA (0.56) MAPTGAALMNAKMT2AMEN1
SCHEMBL28310210 0.76 NR1H4 (0.58) MAPTGAALMNAKMT2AMEN1
SCHEMBL10694146 0.75 KMT2A (0.54) MAPTGAALMNAKMT2AMEN1
SCHEMBL28310196 0.74 MAPT (0.44) MAPTGAALMNAKMT2AMEN1
SCHEMBL9279519 0.73 LMNA (0.51) MAPTGAALMNAKMT2AMEN1
SCHEMBL11044715 0.73 KMT2A (0.51) MAPTGAALMNAKMT2AMEN1
SCHEMBL28310195 0.73 MAPT (0.40) MAPTGAALMNAKMT2AMEN1
SCHEMBL25863485 0.73 LMNA (0.55) MAPTLMNAKMT2AMEN1HTT

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-110099898-A compound and use thereof 优曼尼蒂治疗公司 2019-08-06 CN disclosed