SCHEMBL29956092

SCHEMBL29956092

CC(C)(C)c1nn(-c2ccccc2)c(Cl)c1C=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
HSP90AA1 P07900 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 6/20 0.45
ALDH1A1 P00352 6/20 0.45
MAPT P10636 5/20 0.45
NPSR1 Q6W5P4 3/20 0.45
RECQL P46063 2/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
TP53 P04637 2/20 0.44
HTT P42858 2/20 0.43
MAPK1 P28482 3/20 0.42
ATM Q13315 1/20 0.42
HPGD P15428 2/20 0.40
KDM4C Q9H3R0 1/20 0.40
GRN P28799 1/20 0.39
SORT1 Q99523 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL15331096 0.88 MAPT (0.41) KMT2AMEN1HSP90AA1SMN1; SMN2LMNA
SCHEMBL15331232 0.87 KMT2A (0.45) KMT2AMEN1HSP90AA1SMN1; SMN2LMNA
SCHEMBL15332774 0.87 MAPT (0.41) KMT2AMEN1HSP90AA1SMN1; SMN2LMNA
SCHEMBL29953433 0.87 KMT2A (0.36) KMT2AMEN1HSP90AA1SMN1; SMN2LMNA
SCHEMBL15331087 0.85 MAPT (0.41) KMT2AMEN1HSP90AA1SMN1; SMN2LMNA
SCHEMBL3381554 0.85 SMN1; SMN2 (0.43) SMN1; SMN2LMNAALDH1A1MAPTNPSR1
SCHEMBL15332571 0.85 RIPK2 (0.51) KMT2AMEN1HSP90AA1LMNAALDH1A1
SCHEMBL15330529 0.84 MAPK14 (0.41) KMT2AMEN1HSP90AA1SMN1; SMN2LMNA
SCHEMBL15330023 0.84 KMT2A (0.38) KMT2AMEN1HSP90AA1LMNAALDH1A1
SCHEMBL5904701 0.83 BRAF (0.42) KMT2AMEN1HSP90AA1SMN1; SMN2LMNA

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed