SCHEMBL26231024

SCHEMBL26231024

O=C(Nc1ccn(CC(CO)CO)c(=O)n1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.53
RIN1 Q13671 1/20 0.53
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.45
LMNA P02545 3/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
NT5E P21589 1/20 0.41
P2RY6 Q15077 1/20 0.41
P2RY14 Q15391 1/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP2C9 P11712 1/20 0.40
HTT P42858 1/20 0.40
ADORA3 P0DMS8 1/20 0.39
ADORA1 P30542 1/20 0.39
MAP3K5 Q99683 1/20 0.38
HCAR3 P49019 1/20 0.38

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
SCHEMBL26230857 0.94 ABL1 (0.50) ABL1RIN1KMT2AMEN1POLB
SCHEMBL26230900 0.94 ABL1 (0.50) ABL1RIN1KMT2AMEN1POLB
SCHEMBL27727547 0.89 ABL1 (0.49) ABL1RIN1KMT2AMEN1POLB
SCHEMBL27057456 0.86 KMT2A (0.50) ABL1RIN1KMT2AMEN1POLB
SCHEMBL27056601 0.83 KMT2A (0.47) ABL1RIN1KMT2AMEN1POLB
SCHEMBL27056608 0.83 KMT2A (0.47) ABL1RIN1KMT2AMEN1POLB
SCHEMBL9195212 0.83 KMT2A (0.47) ABL1RIN1KMT2AMEN1POLB
SCHEMBL22672647 0.82 MEN1 (0.54) ABL1RIN1KMT2AMEN1POLB
SCHEMBL452423 0.82 KMT2A (0.54) ABL1RIN1KMT2AMEN1POLB
SCHEMBL6055222 0.80 ABL1 (0.52) ABL1RIN1KMT2AMEN1POLB

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
US-20230287418-A1 MODIFIED SIRNA WITH REDUCED OFF-TARGET ACTIVITY TUOJIE BIOTECH(SHANGHAI) CO., LTD. (CN) 2023-09-14 US disclosed