SCHEMBL8046930

SCHEMBL8046930

O=C(CCCCCCC(c1ccccc1)(c1ccccc1)c1ccccc1)NO

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 10/20 0.59
HDAC1 Q13547 15/20 0.58
HDAC8 Q9BY41 13/20 0.58
HDAC2 Q92769 9/20 0.58
HDAC5 Q9UQL6 7/20 0.58
HDAC11 Q96DB2 7/20 0.58
HDAC3 O15379 7/20 0.58
HDAC4 P56524 6/20 0.58
HDAC7 Q8WUI4 6/20 0.58
HDAC9 Q9UKV0 6/20 0.58
HDAC10 Q969S8 6/20 0.58
NCOR2 Q9Y618 2/20 0.58
ALOX5 P09917 1/20 0.58
KDM4E B2RXH2 1/20 0.58
BRD4 O60885 1/20 0.58
NCOR1 O75376 1/20 0.58
NR1I2 O75469 1/20 0.58
EGFR P00533 1/20 0.58
CYP3A4 P08684 1/20 0.58
LTA4H P09960 1/20 0.58

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
SCHEMBL6380097 0.85 KIF11 (0.49) HDAC6HDAC1HDAC8HDAC2HDAC5
SCHEMBL1635914 0.82 HDAC3 (0.53) HDAC6HDAC1HDAC8HDAC2HDAC5
SCHEMBL1633685 0.80 KIF11 (0.53) HDAC6HDAC1HDAC8HDAC2HDAC5
SCHEMBL8035139 0.80 HDAC1 (0.51) HDAC6HDAC1HDAC8HDAC2HDAC5
SCHEMBL8035137 0.80 HDAC1 (0.51) HDAC6HDAC1HDAC8HDAC2HDAC5
SCHEMBL6365975 0.80 KIF11 (0.46) HDAC6HDAC1HDAC8HDAC2HDAC5
SCHEMBL8360046 0.79 HDAC1 (0.66) HDAC6HDAC1HDAC8HDAC2HDAC5
Phosphine SCHEMBL29270354 0.79 KIF11 (0.52) HDAC6HDAC1HDAC8HDAC2HDAC5
SCHEMBL8044651 0.78 HDAC1 (0.50) HDAC6HDAC1HDAC8HDAC2HDAC5
SCHEMBL9874219 0.78 KIF11 (0.55) CYP3A4KCNH2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0749957-B1 Aromatic hydroxamic acid compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-04-26 EP disclosed
US-5891916-A ANTINEUROGEGERATIVE AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-04-06 US disclosed
EP-0749957-A1 Aromatic hydroxamic acid compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1996-12-27 EP disclosed