SCHEMBL5369178

SCHEMBL5369178

O=C(O)C1CCCN(Cc2ccccc2)C1=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
POLB P06746 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
ALDH1A1 P00352 2/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
TSHR P16473 1/20 0.43

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
SCHEMBL9740346 0.95 L3MBTL1 (0.51) L3MBTL1KMT2AMEN1POLBCYP2D6
SCHEMBL9205385 0.94 L3MBTL1 (0.54) L3MBTL1KMT2AMEN1POLBCYP2D6
SCHEMBL892946 0.91 HDAC1 (0.51) KMT2AMEN1POLBCYP2D6CYP2C9
SCHEMBL27491805 0.91 HDAC1 (0.51) KMT2AMEN1POLBCYP2D6CYP2C9
SCHEMBL6198420 0.88 L3MBTL1 (0.47) L3MBTL1KMT2AMEN1POLBCYP2D6
SCHEMBL28116468 0.85 CCR8 (0.51) KMT2AMEN1ALDH1A1GAA
SCHEMBL5361723 0.84 POLB (0.53) KMT2APOLBCYP2C9CYP2C19ALDH1A1
Hydrochloric Acid SCHEMBL5555279 0.84 FKBP1A (0.54) L3MBTL1KMT2AMEN1POLBCYP2D6
SCHEMBL14345645 0.83 MEN1 (0.59) L3MBTL1KMT2AMEN1POLBCYP2D6
Hydrochloric Acid SCHEMBL10813366 0.82 MEN1 (0.58) L3MBTL1KMT2AMEN1POLBCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007138110-A2 COMPOUNDS THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE KV FAMILY DEVGEN N.V. (BE) 2007-12-06 WO claimed
CN-109562113-A Spirocyclo-rongeur for target protein degradation C4医药公司 2019-04-02 CN disclosed
WO-2007138110-A2 COMPOUNDS THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE KV FAMILY DEVGEN N.V. (BE) 2007-12-06 WO disclosed