SCHEMBL8364244

SCHEMBL8364244

COCC(=O)N1CCCC(N(Cc2ccc(C(=O)OC)cc2)S(=O)(=O)c2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC3 O15379 1/20 0.44
RORC P51449 1/20 0.44
CNR1 P21554 1/20 0.43
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42
POLB P06746 1/20 0.41
PSEN1 P49768 3/20 0.40
PSEN2 P49810 3/20 0.40
APH1B Q8WW43 3/20 0.40
NCSTN Q92542 3/20 0.40
APH1A Q96BI3 3/20 0.40
PSENEN Q9NZ42 3/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
BMP1 P13497 1/20 0.40
LMNA P02545 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
SCHEMBL8364256 0.91 HDAC6 (0.46) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8364249 0.91 CNR1 (0.45) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8364401 0.91 HDAC6 (0.44) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8361728 0.91 RORC (0.51) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8361739 0.90 HDAC6 (0.46) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8364250 0.89 KMT2A (0.47) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8363852 0.89 ALOX15 (0.47) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8364382 0.89 CNR1 (0.49) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8363828 0.88 HDAC6 (0.44) HDAC6KMT2AMEN1HDAC8HDAC3
SCHEMBL8361730 0.88 RORC (0.46) HDAC6KMT2AMEN1HDAC8HDAC3

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
WO-2003013527-A1 SULFONAMIDE DERIVATIVES AS GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2003-02-20 WO disclosed