SCHEMBL9506078

SCHEMBL9506078

CN(O)C(=O)c1ccc(CCCCc2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.63
HDAC1 Q13547 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HDAC8 Q9BY41 1/20 0.51
THRA P10827 1/20 0.51
THRB P10828 1/20 0.51
RCE1 Q9Y256 1/20 0.50
MLYCD O95822 1/20 0.49
DPP4 P27487 1/20 0.49
MAPT P10636 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
SIGMAR1 Q99720 1/20 0.49

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
SCHEMBL10638440 0.93 ALOX5 (0.51) ALOX5MEN1KMT2ATHRATHRB
SCHEMBL10638436 0.90 RARB (0.58) ALOX5MEN1KMT2ATHRATHRB
SCHEMBL9504749 0.86 THRA (0.59) MEN1KMT2ATHRATHRBMAPT
SCHEMBL10641307 0.85 SLC16A3 (0.52) ALOX5
SCHEMBL9508299 0.85 ALOX5 (0.58) ALOX5MEN1KMT2AMAPTRXFP1
SCHEMBL9508189 0.85 THRA (0.61) MEN1KMT2ATHRATHRBMAPT
SCHEMBL9504888 0.85 THRA (0.61) MEN1KMT2ATHRATHRBMAPT
SCHEMBL9504649 0.85 THRA (0.61) MEN1KMT2ATHRATHRBMAPT
SCHEMBL9504685 0.85 THRA (0.61) MEN1KMT2ATHRATHRBMAPT
SCHEMBL9508248 0.85 THRA (0.61) MEN1KMT2ATHRATHRBMAPT

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