SCHEMBL11286755

SCHEMBL11286755

CC(C)Oc1ccc(CC(=O)Oc2cc(C(CNC(C)(C)C)CS(=O)(=O)O)ccc2OC(=O)CCCCCC(C)(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
POLB P06746 1/20 0.32
CNR2 P34972 1/20 0.32
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL11286759 0.89 LMNA (0.38) ALOX15KMT2A
SCHEMBL11286752 0.86 ALOX15 (0.34) ALOX15POLBCNR2KMT2AL3MBTL1
SCHEMBL11283673 0.81 ALOX15 (0.36) ALOX15KMT2A
SCHEMBL11288390 0.80 ALOX15 (0.45) ALOX15KMT2A
SCHEMBL11283807 0.80 ALOX15 (0.45) ALOX15KMT2A
SCHEMBL11287417 0.80 ALOX15 (0.45) ALOX15KMT2A
SCHEMBL11291983 0.80 ALOX15 (0.37) ALOX15POLBCNR2KMT2AL3MBTL1
SCHEMBL11286758 0.77 LMNA (0.38) KMT2A
SCHEMBL11290106 0.76 TBXA2R (0.40) ALOX15KMT2AL3MBTL1
Alcohol SCHEMBL11286751 0.75 ALOX15 (0.36) ALOX15POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4336400-A BRONCHODILATOR AGENTS, CARDIOVASCULAR STIMULANTS STERLING DRUG INC. (US) 1982-06-22 US disclosed
US-RE30241-E BRONCHODILATION, ADRENERGIC STIMULANTS STERLING DRUG INC. (US) 1980-03-25 US disclosed