SCHEMBL6138887

SCHEMBL6138887

O=C(CCCCC(O)c1ccc(-c2ccc(CCN3CCOCC3)cc2)cc1)NO

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 4/20 0.45
HDAC2 Q92769 3/20 0.45
HDAC8 Q9BY41 2/20 0.45
HDAC7 Q8WUI4 2/20 0.45
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
MMP1 P03956 2/20 0.41
MMP2 P08253 2/20 0.41
MMP3 P08254 2/20 0.41
EPHX2 P34913 1/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL6138498 1.00 HDAC1 (0.45) HDAC1HDAC2HDAC8HDAC7HDAC3
Hydrochloric Acid SCHEMBL6138891 0.99 HDAC1 (0.45) HDAC1HDAC2HDAC8HDAC7HDAC3
Hydrochloric Acid SCHEMBL6138898 0.99 HDAC1 (0.45) HDAC1HDAC2HDAC8HDAC7HDAC3
SCHEMBL6138501 0.89 HRH3 (0.51) HDAC1HDAC2HDAC8HDAC7HDAC3
SCHEMBL6138545 0.89 HRH3 (0.51) HDAC1HDAC2HDAC8HDAC7HDAC3
Hydrochloric Acid SCHEMBL6138827 0.88 HRH3 (0.50) HDAC1HDAC2HDAC8HDAC7HDAC3
Hydrochloric Acid SCHEMBL6138839 0.88 HRH3 (0.50) HDAC1HDAC2HDAC8HDAC7HDAC3
SCHEMBL6138521 0.85 HDAC1 (0.54) HDAC1HDAC2HDAC8HDAC7HDAC3
SCHEMBL6138524 0.85 HDAC1 (0.54) HDAC1HDAC2HDAC8HDAC7HDAC3
Hydrochloric Acid SCHEMBL6138728 0.84 HDAC1 (0.53) HDAC1HDAC2HDAC8HDAC7HDAC3

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-1215203-B1 HYDROXAMIC ACID DERIVATIVES, PROCESS FOR THE PRODUCTION THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2005-02-16 EP claimed
US-6770644-B1 Hydroxamic acid derivatives, process for the production thereof and drug containing the same as the active ingredient ONO PHARMACEUTICALS CO., LTD. (JP) 2004-08-03 US claimed
EP-1215203-A1 HYDROXAMIC ACID DERIVATIVES, PROCESS FOR THE PRODUCTION THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-06-19 EP claimed