SCHEMBL29066255

SCHEMBL29066255

O=C(O)CCNN1C(=O)c2cccc3cccc1c23

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KDM4E B2RXH2 6/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ HPGD P15428 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ AKR1B1 P15121 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ POLB P06746 1/20 0.48
▸ CASP1 P29466 2/20 0.47
▸ GAA P10253 1/20 0.47
▸ CASP7 P55210 1/20 0.47
▸ MPI P34949 1/20 0.46
▸ CACNA1B Q00975 1/20 0.46
▸ APBA1 Q02410 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ UBE2N P61088 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
SCHEMBL24330030 0.85 POLB (0.61) KMT2AKDM4EALDH1A1HPGDMAPT
SCHEMBL30660067 0.79 MEN1 (0.50) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL8011548 0.79 MEN1 (0.50) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL26691523 0.78 KDM4E (0.52) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL9290373 0.75 MEN1 (0.67) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL27856264 0.73 NTRK1 (0.67) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL11181448 0.72 KDM4E (0.79) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL29583059 0.70 CTRB1 (0.47) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL24330033 0.70 CTRB1 (0.47) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL4582152 0.70 MEN1 (0.82) KMT2AMEN1KDM4EALDH1A1HPGD

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
CN-116723839-A Tricyclic heterobifunctional compounds for degrading target proteins C4医药公司 2023-09-08 — — CN disclosed
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