SCHEMBL9508884

SCHEMBL9508884

CCCCCCCCCCc1ccc(C(=O)N(CC)OCCCCC)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 10/20 0.51
THRB P10828 10/20 0.51
RARB P10826 5/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 1/20 0.51
RARA P10276 1/20 0.51
MAPT P10636 1/20 0.51
MTOR P42345 1/20 0.51
PLA2G1B P04054 1/20 0.48
ATG4B Q9Y4P1 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
SCHEMBL9508783 0.90 THRA (0.52) THRATHRBRARBMEN1KMT2A
SCHEMBL9506028 0.90 THRA (0.52) THRATHRBRARBMEN1KMT2A
SCHEMBL9504622 0.88 THRA (0.52) THRATHRBRARBMEN1KMT2A
SCHEMBL9504771 0.85 THRA (0.54) THRATHRBRARBMEN1KMT2A
SCHEMBL9504801 0.81 THRA (0.58) THRATHRBRARBMEN1KMT2A
SCHEMBL9506911 0.81 THRA (0.57) THRATHRBRARBMEN1KMT2A
SCHEMBL27671411 0.81 THRA (0.53) THRATHRBRARBMEN1KMT2A
SCHEMBL3185726 0.81 THRA (0.61) THRATHRBRARBMEN1KMT2A
SCHEMBL2399439 0.81 THRA (0.61) THRATHRBRARBMEN1KMT2A
SCHEMBL9508886 0.76 THRA (0.52) THRATHRBRARBMEN1KMT2A

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 5 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 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