SCHEMBL24823213

SCHEMBL24823213

CNCCCCCCCCNC(=O)Cn1c2ccccc2c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.53
KDM4E B2RXH2 2/20 0.49
POLB P06746 3/20 0.46
THRB P10828 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HDAC6 Q9UBN7 4/20 0.46
HDAC1 Q13547 4/20 0.46
TSPO P30536 1/20 0.46
MARK4 Q96L34 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
LMNA P02545 2/20 0.45
TSHR P16473 1/20 0.44
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
HDAC2 Q92769 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL24822425 0.86 GRIN1 (0.59) CNR2KDM4EHDAC6HDAC1GRIN1
SCHEMBL24822609 0.79 GRIN1 (0.66) POLBGRIN1GRIN2AGRIN2B
SCHEMBL24822562 0.79 ATM (0.42) CNR2POLBHDAC6HDAC1
SCHEMBL25594457 0.77 MAOA (0.55) HDAC6HDAC1GRIN1GRIN2AGRIN2B
SCHEMBL24822498 0.75 TSHR (0.53) CNR2POLBSMN1; SMN2LMNATSHR
SCHEMBL11712442 0.73 FABP4 (0.51) HDAC6HDAC1GRIN1GRIN2AGRIN2B
SCHEMBL31160335 0.72 KDM4E (0.61) KDM4EPOLBL3MBTL1HDAC6HDAC1
SCHEMBL28044712 0.72 KDM4E (0.61) KDM4EPOLBL3MBTL1HDAC6HDAC1
SCHEMBL24823211 0.71 KMT2A (0.47) POLBTHRBL3MBTL1HDAC6HDAC1
SCHEMBL4381790 0.71 HDAC6 (0.56) CNR2KDM4EHDAC6HDAC1HDAC2

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-2022268066-A1 PROTEIN DEGRADATION AGENT 苏州开拓药业股份有限公司 2022-12-29 WO disclosed