SCHEMBL11289203

SCHEMBL11289203

CCOC(=O)CCC(=O)c1cc(C(C)(C)C)cc(N)c1O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
MAPT P10636 4/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
POLB P06746 2/20 0.34
NR5A2 O00482 1/20 0.34
NR5A1 Q13285 1/20 0.34
CYP1A2 P05177 1/20 0.34
STING1 Q86WV6 2/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL11293235 0.94 CYP1A2 (0.40) HSP90AA1HSP90AB1MAPTMEN1GAA
Hydrochloric Acid SCHEMBL11295054 0.92 CYP1A2 (0.39) HSP90AA1HSP90AB1MAPTMEN1GAA
SCHEMBL11307428 0.88 MIF (0.40) HSP90AA1HSP90AB1MAPTMEN1GAA
SCHEMBL11323654 0.86 VCAM1 (0.40) HSP90AA1HSP90AB1MAPTMEN1GAA
SCHEMBL11289849 0.83 ALDH1A1 (0.45) HSP90AA1HSP90AB1MAPTMEN1GAA
SCHEMBL11288073 0.81 CYP3A4 (0.41) MEN1GAAKMT2ANPC1RAB9A
SCHEMBL11288410 0.81 CYP1A2 (0.36) MAPTMEN1GAAKMT2ACYP2C9
SCHEMBL11288335 0.81 NR5A2 (0.46) HSP90AA1HSP90AB1MAPTMEN1GAA
SCHEMBL11286999 0.80 TSHR (0.41) HSP90AA1HSP90AB1MAPTMEN1GAA
SCHEMBL11210138 0.80 CYP4F2 (0.43) MAPTMEN1GAAKMT2ACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0065874-A1 2-Aminophenol derivatives, methods for their preparation and composition containing the same ONO PHARMACEUTICAL CO., LTD. (JP) 1982-12-01 EP disclosed