SCHEMBL7806507

SCHEMBL7806507

O=C(Nc1cccc(Cl)c1)c1ccc(OCCO)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.70
MAPT P10636 2/20 0.70
NPC1 O15118 5/20 0.61
RAB9A P51151 5/20 0.61
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
ALDH1A1 P00352 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
NR1H4 Q96RI1 4/20 0.57
POLB P06746 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
ADORA3 P0DMS8 1/20 0.55
ADORA2A P29274 1/20 0.55
ADORA2B P29275 1/20 0.55
ADORA1 P30542 1/20 0.55
KCNK3 O14649 1/20 0.55
KCNK9 Q9NPC2 1/20 0.55

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
SCHEMBL7814785 0.88 TP53 (0.54) TP53MAPTNPC1RAB9AMEN1
SCHEMBL5182631 0.85 THRB (0.64) TP53MAPTNPC1RAB9AMEN1
SCHEMBL5180990 0.81 MAPT (0.64) TP53MAPTNPC1RAB9AMEN1
SCHEMBL22192224 0.81 MAPT (0.64) TP53MAPTNPC1RAB9AMEN1
SCHEMBL7819911 0.81 MAPT (0.61) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL3788426 0.81 NPC1 (0.76) TP53NPC1RAB9AMEN1KMT2A
SCHEMBL4255341 0.80 NPC1 (0.81) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL27858304 0.80 NPC1 (0.75) TP53NPC1RAB9AMEN1KMT2A
SCHEMBL5181024 0.79 THRB (0.60) TP53MAPTNPC1RAB9AMEN1
SCHEMBL5181338 0.78 THRB (0.75) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1

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
EP-1077929-A1 2,3,5-SUBSTITUTED BIPHENYLS USEFUL IN THE TREATMENT OF INSULIN RESISTANCE AND HYPERGLYCEMIA AMERICAN HOME PRODUCTS CORPORATION (US) 2001-02-28 EP disclosed
WO-1999061410-A1 2,3,5-SUBSTITUTED BIPHENYLS USEFUL IN THE TREATMENT OF INSULIN RESISTANCE AND HYPERGLYCEMIA AMERICAN HOME PRODUCTS CORPORATION (US) 1999-12-02 WO disclosed