SCHEMBL9504638

SCHEMBL9504638

O=C(c1ccc(CCCCc2ccccc2)cc1)N(O)Cc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.64
HDAC1 Q13547 2/20 0.53
HDAC8 Q9BY41 2/20 0.53
HDAC3 O15379 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
RCE1 Q9Y256 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
LPAR1 Q92633 2/20 0.49
CRHBP P24387 1/20 0.49
CRHR2 Q13324 1/20 0.49
LPAR5 Q9H1C0 1/20 0.48

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
SCHEMBL9508914 0.91 THRA (0.56) ALOX5MEN1KMT2A
SCHEMBL7646415 0.86 HSD11B1 (0.54) ALOX5HDAC1HDAC8HDAC3HDAC7
SCHEMBL9504831 0.85 ALOX5 (0.51) ALOX5HDAC1HDAC8HDAC6RCE1
SCHEMBL9504847 0.83 ALOX5 (0.55) ALOX5HDAC1HDAC6RCE1
SCHEMBL9506661 0.81 HDAC1 (0.48) ALOX5HDAC1HDAC8RCE1MEN1
SCHEMBL9506078 0.81 ALOX5 (0.63) ALOX5HDAC1HDAC8RCE1MEN1
SCHEMBL9506247 0.80 KDM4E (0.55) ALOX5HDAC1HDAC8HDAC3HDAC7
SCHEMBL28312776 0.79 ALOX5 (0.65) ALOX5HDAC1HDAC8HDAC3HDAC7
SCHEMBL9504721 0.79 THRA (0.63) ALOX5MEN1KMT2A
SCHEMBL5760810 0.78 HDAC1 (0.46) ALOX5HDAC1HDAC8HDAC3HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0161939-B1 ARYLHYDROXAMATES E.R. Squibb & Sons, Inc. (US) 1993-07-21 EP claimed
US-4607053-A L2POXYGENASE INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US claimed
EP-0161939-A2 Arylhydroxamates E.R. Squibb & Sons, Inc. (US) 1985-11-21 EP claimed
EP-0161939-B1 ARYLHYDROXAMATES E.R. Squibb & Sons, Inc. (US) 1993-07-21 EP disclosed
CN-1012500-B Process for preparing aryl hydroxamates SQUIBB & SONS INC (US) 1991-05-01 CN disclosed
CN-85104470-A The method for preparing arythydroxamtes 1986-10-01 CN disclosed
US-4607053-A L2POXYGENASE INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US disclosed
EP-0161939-A2 Arylhydroxamates E.R. Squibb & Sons, Inc. (US) 1985-11-21 EP disclosed