SCHEMBL7946700

SCHEMBL7946700

CC(C)(C)OC(=O)C1c2ccccc2-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
NCOR2 Q9Y618 1/20 0.47
POLB P06746 3/20 0.46
ALDH1A1 P00352 3/20 0.42
HBB P68871 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.38
EDNRB P24530 1/20 0.37
EDNRA P25101 1/20 0.37
RECQL P46063 1/20 0.37
CDK1 P06493 1/20 0.37
GAA P10253 1/20 0.36

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
SCHEMBL7945050 0.81 ATM (0.55) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL106257 0.79 HDAC4 (0.57) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL26412861 0.76 MEN1 (0.41) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL18025887 0.76 POLB (0.56) HDAC3HDAC4HDAC7HDAC8HDAC6
Bromomethane SCHEMBL4427405 0.76 HDAC4 (0.53) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL7596808 0.75 POLB (0.47) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL17605695 0.75 GLS (0.41) POLBALDH1A1HBBHSD17B10MAPK1
SCHEMBL25629836 0.75 HDAC3 (0.41) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL28233308 0.75 HDAC3 (0.52) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL409869 0.75 ALDH1A1 (0.66) HDAC3HDAC4HDAC7HDAC8HDAC6

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-6251558-B1 Chemically amplified resist SIEMENS AKTIENGESELLSCHAFT (DE) 2001-06-26 US disclosed