SCHEMBL22064263

SCHEMBL22064263

CC(O)c1cnn2c1ccc1ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
UGT2B7 P16662 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
BRD4 O60885 1/20 0.33
BRPF1 P55201 1/20 0.33
KAT2B Q92831 1/20 0.33
BRD9 Q9H8M2 1/20 0.33
MAPT P10636 1/20 0.33
PBRM1 Q86U86 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TP53 P04637 1/20 0.33
CDK2 P24941 2/20 0.32
CDK7 P50613 2/20 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
SCHEMBL13920765 0.88 DRD4 (0.39) TDP1DRD4DRD3UGT2B7MEN1
SCHEMBL12145712 0.75 DRD4 (0.41) TDP1DRD4DRD3CA12CA9
SCHEMBL22063786 0.73 MAPK1 (0.44) TDP1DRD4DRD3CA12CA9
SCHEMBL18750846 0.70 CYP17A1 (0.42) TDP1DRD4DRD3MEN1KMT2A
SCHEMBL6608758 0.70 DRD4 (0.42) DRD4DRD3MEN1KMT2ASMN1; SMN2
SCHEMBL29750424 0.68 KDM4D (0.45) DRD4DRD3MEN1KMT2AALDH1A1
SCHEMBL12146185 0.68 DRD4 (0.39) TDP1DRD4DRD3SMN1; SMN2ALDH1A1
SCHEMBL12145711 0.65 ALDH1A1 (0.41) CA12CA9SMN1; SMN2ALDH1A1BRD4
SCHEMBL18750790 0.64 DRD4 (0.36) DRD4DRD3MEN1KMT2ACA12
SCHEMBL23132317 0.63 DRD2 (0.38) DRD4DRD3TSHRLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746229-B2 Resin composition and molded body using same Konica Minolta, Inc. (JP) 2023-09-05 US disclosed
US-20200181401-A1 Resin Composition and Molded Body Using Same Konica Minolta, Inc. (JP) 2020-06-11 US disclosed