SCHEMBL28840917

SCHEMBL28840917

O=C1c2ccccc2CN1N1C(=O)[CH]CCC1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.59
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
RNASEH1 O60930 1/20 0.38
PKM P14618 3/20 0.38
GAA P10253 2/20 0.36
TLR9 Q9NR96 2/20 0.36
ALOX15 P16050 3/20 0.36
KDM4E B2RXH2 2/20 0.36
TSHR P16473 2/20 0.36
SIRT1 Q96EB6 1/20 0.36
CRBN Q96SW2 1/20 0.36
ALDH1A1 P00352 2/20 0.35
XIAP P98170 1/20 0.35
HKDC1 Q2TB90 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP11B2 P19099 1/20 0.35
MEN1 O00255 3/20 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
SCHEMBL23832541 0.81 KMT2A (0.67) KMT2ANPC1RAB9ARNASEH1PKM
SCHEMBL29569183 0.81 KMT2A (0.67) KMT2ANPC1RAB9ARNASEH1PKM
Hydrochloric Acid SCHEMBL4557636 0.80 KMT2A (0.65) KMT2ANPC1RAB9ARNASEH1PKM
Diftalone SCHEMBL35351 0.76 KMT2A (1.00) KMT2ANPC1RAB9ARNASEH1PKM
Diftalone SCHEMBL29644941 0.76 KMT2A (1.00) KMT2ANPC1RAB9ARNASEH1PKM
SCHEMBL31352634 0.76 KMT2A (0.59) KMT2ANPC1RAB9ARNASEH1PKM
Formic Acid SCHEMBL38654533 0.75 KMT2A (0.57) KMT2ANPC1RAB9ARNASEH1PKM
SCHEMBL28411858 0.72 KMT2A (0.54) KMT2ANPC1RAB9ARNASEH1PKM
SCHEMBL30736409 0.71 KMT2A (0.61) KMT2ANPC1RAB9ARNASEH1PKM
Trifluoroacetic Acid SCHEMBL30727536 0.71 KMT2A (0.51) KMT2ANPC1RAB9ARNASEH1PKM

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
CN-115038448-A Compounds that modulate protein recruitment and/or degradation 奥里尼斯生物科学股份有限公司 2022-09-09 CN claimed
CN-112638380-B Cerebellar protein (CRBN) ligands 达纳-法伯癌症研究所有限公司 2024-05-24 CN disclosed
CN-115038448-A Compounds that modulate protein recruitment and/or degradation 奥里尼斯生物科学股份有限公司 2022-09-09 CN disclosed