SCHEMBL25678151

SCHEMBL25678151

CC(C)n1c2ccccc2c2c3oc4c(c3ccc21)CCC=C4

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPY5R Q15761 7/20 0.37
UTS2R Q9UKP6 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
BCHE P06276 1/20 0.32
ACHE P22303 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
SCHEMBL17833734 0.79 POLB (0.48) MEN1KMT2ACYP1A2POLBCYP3A4
SCHEMBL17833733 0.77 MEN1 (0.44) MEN1KMT2ACYP1A2POLBCYP3A4
SCHEMBL25678294 0.76 PGR (0.32)
SCHEMBL22592206 0.76
SCHEMBL25689441 0.74 NPY5R (0.37) MEN1KMT2ANPY5RUTS2RMAPT
SCHEMBL16383694 0.73 MEN1 (0.31) MEN1KMT2APOLBMAPTTSHR
SCHEMBL17381333 0.71 TSHR (0.39) MEN1KMT2ACYP1A2POLBCYP3A4
SCHEMBL20019412 0.70
SCHEMBL25702407 0.69 MEN1 (0.41) MEN1KMT2ACYP1A2POLBCYP3A4
SCHEMBL25678457 0.69 NPY5R (0.35) MEN1KMT2ANPY5RUTS2RMAPT

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
EP-4190791-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT Kyulux, Inc. (JP) 2023-06-07 EP disclosed