SCHEMBL5598503

SCHEMBL5598503

CC(C)(C)c1cc(C(=O)O)cc(C(C)(C)C)c1O.CCC(C)(C)c1ccc(O)c(C(C)(C)CC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.44
HSP90AB1 P08238 2/20 0.44
LMNA P02545 1/20 0.43
RECQL P46063 1/20 0.43
RARG P13631 3/20 0.43
RARB P10826 2/20 0.43
RARA P10276 2/20 0.43
CYP2C9 P11712 2/20 0.42
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GLRA3 O75311 1/20 0.40
GLRB P48167 1/20 0.40
TNFRSF1A P19438 1/20 0.39

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
SCHEMBL7792941 0.84 LMNA (0.54) LMNARECQLRARGRARAPOLB
Butylated Hydroxytoluene SCHEMBL6357421 0.82 SMN1; SMN2 (0.51) LMNACYP2C9POLBMEN1KMT2A
SCHEMBL3805383 0.81 RARB (0.51) HSP90AA1HSP90AB1RARGRARBRARA
SCHEMBL29481306 0.81 MAPK1 (0.48) LMNARECQLCYP2C9NPC1RAB9A
Butylated Hydroxytoluene SCHEMBL5336005 0.81 SMN1; SMN2 (0.50) LMNACYP2C9POLBMEN1KMT2A
SCHEMBL80891 0.81 MAPK1 (0.48) LMNARECQLCYP2C9NPC1RAB9A
SCHEMBL1239911 0.80 ALDH1A1 (0.53) HSP90AA1HSP90AB1LMNARECQLCYP2C9
Hydrochloric Acid SCHEMBL7076597 0.80 MAPK1 (0.47) LMNARECQLCYP2C9NPC1RAB9A
SCHEMBL9446389 0.80 LMNA (0.46) LMNARECQLCYP2C9NPC1POLB
SCHEMBL29350935 0.77 NPSR1 (0.51) HSP90AA1LMNARECQLCYP2C9NPC1

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-7160587-B2 Plastic substrate for display and display element TOSOH CORPORATION (JP) 2007-01-09 US disclosed
US-20050059777-A1 Plastic substrate for display and display element TOSOH CORPORATION (JP) 2005-03-17 US disclosed