SCHEMBL24379151

SCHEMBL24379151

CC1CC(=O)NC(=O)C1C1Cc2ccccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.49
TSHR P16473 1/20 0.42
BRD4 O60885 4/20 0.41
CREBBP Q92793 3/20 0.41
METAP1 P53582 2/20 0.39
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
EP300 Q09472 1/20 0.36
HTR2A P28223 4/20 0.35
HTR2C P28335 4/20 0.35
HTR2B P41595 4/20 0.35
TDP2 O95551 1/20 0.35
CASP3 P42574 1/20 0.35
CASP7 P55210 1/20 0.35
CASP9 P55211 1/20 0.35
CASP6 P55212 1/20 0.35
CASP8 Q14790 1/20 0.35
MAP3K14 Q99558 1/20 0.35
CRBN Q96SW2 1/20 0.35

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
SCHEMBL24379419 0.79 BRD4 (0.39) ACHETSHRBRD4CREBBPEP300
SCHEMBL14157895 0.74 ACHE (0.63) ACHETSHRMETAP1
SCHEMBL20128633 0.74 ACHE (0.49) ACHETSHRHTR2AHTR2CHTR2B
SCHEMBL22151224 0.73 ACHE (0.43) ACHETSHRMETAP1CASP7
SCHEMBL20128664 0.71 ACHE (0.49) ACHETSHRMETAP1NOS3TDP2
SCHEMBL11776080 0.68 ACHE (0.61) ACHETSHRMETAP1NOS3NOS2
SCHEMBL16691536 0.68 ACHE (0.66) ACHETSHRMETAP1NOS3NOS2
SCHEMBL7939001 0.68 ACHE (0.65) ACHETSHRMETAP1HTR2AHTR2C
SCHEMBL3054005 0.68 ACHE (0.66) ACHETSHRMETAP1NOS3NOS2
SCHEMBL9752693 0.67 ACHE (1.00) ACHETSHRMETAP1NOS3NOS2

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
WO-2022087125-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR PROTEIN ARVINAS OPERATIONS, INC. (US) 2022-04-28 WO disclosed