SCHEMBL8667875

SCHEMBL8667875

[CH2]Cc1ccc(NC(=O)CBr)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
GAA P10253 2/20 0.47
POLB P06746 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
CHRM1 P11229 1/20 0.43
HDAC3 O15379 3/20 0.41
HDAC4 P56524 3/20 0.41
HDAC1 Q13547 3/20 0.41
HDAC7 Q8WUI4 3/20 0.41
HDAC2 Q92769 3/20 0.41
HDAC10 Q969S8 3/20 0.41
HDAC11 Q96DB2 3/20 0.41
HDAC8 Q9BY41 3/20 0.41
HDAC6 Q9UBN7 3/20 0.41
HDAC9 Q9UKV0 3/20 0.41
HDAC5 Q9UQL6 3/20 0.41
EPHX2 P34913 1/20 0.41

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
SCHEMBL15267699 0.87 KMT2A (0.60) KMT2AMEN1GAAPOLBLMNA
SCHEMBL1356115 0.86 KMT2A (0.50) KMT2AMEN1GAAPOLBLMNA
SCHEMBL4787002 0.84 KMT2A (0.51) KMT2AMEN1GAAPOLBSMN1; SMN2
SCHEMBL4548528 0.82 TPSAB1 (0.48) KMT2AMEN1GAAPOLBHDAC3
SCHEMBL5362495 0.82 HDAC3 (0.60) KMT2AMEN1SMN1; SMN2LMNAHDAC3
SCHEMBL21765683 0.81 NPC1 (0.50) KMT2AMEN1GAAPOLBLMNA
SCHEMBL8689095 0.81 MEN1 (0.62) KMT2AMEN1GAAPOLBSMN1; SMN2
SCHEMBL6029960 0.80 GAA (0.59) KMT2AMEN1GAAPOLBSMN1; SMN2
SCHEMBL1039601 0.79 KMT2A (0.76) KMT2AMEN1SMN1; SMN2LMNAHTT
SCHEMBL7888049 0.79 CYP1A1 (0.60) KMT2AMEN1GAAPOLBLMNA

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-5821249-A Anhydroecogonine compounds and their use as anticholinergic agents UNIVERSITY OF ROCHESTER (US) 1998-10-13 US claimed