SCHEMBL8630495

SCHEMBL8630495

OC(c1ccccc1)c1cocn1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 4/20 0.39
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
KAT7 O95251 2/20 0.37
KAT6A Q92794 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL31098014 0.81 SMN1; SMN2 (0.54) SMN1; SMN2LMNAKDM4EL3MBTL1SLC6A2
SCHEMBL13733688 0.81 SMN1; SMN2 (0.54) SMN1; SMN2LMNAKDM4EL3MBTL1SLC6A2
SCHEMBL8865472 0.81 PLA2G7 (0.33) KAT7KAT6A
SCHEMBL30556753 0.74 SLC6A2 (0.36) KDM4EL3MBTL1SLC6A2SLC6A4SLC6A3
SCHEMBL23610057 0.69 SLC6A2 (0.63) SMN1; SMN2LMNAKDM4EALDH1A1SLC6A2
SCHEMBL31143646 0.69 SLC6A2 (0.63) SMN1; SMN2LMNAKDM4EALDH1A1SLC6A2
SCHEMBL477369 0.69 SLC6A2 (0.63) SMN1; SMN2LMNAKDM4EALDH1A1SLC6A2
SCHEMBL31143614 0.69 SLC6A2 (0.63) SMN1; SMN2LMNAKDM4EALDH1A1SLC6A2
SCHEMBL30437840 0.69 SMN1; SMN2 (0.47) SMN1; SMN2LMNAKDM4EL3MBTL1ALDH1A1
Diphenylmethanol SCHEMBL6434457 0.68 SMN1; SMN2 (0.61) SMN1; SMN2LMNAKDM4EL3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1047169-C (1-phenyl-1-heterocyclyl) methanol and (1-phenyl-1-heterocyclyl) methylamine derivatives ASTRA AB (SE) 1999-12-08 CN claimed
US-5712299-A TREATMENT OF NEURODEGENERATIVE DISORDERS ASTRA AKTIEBOLAG (SE) 1998-01-27 US claimed
CN-1126991-A Novel (1-phenyl-1-heterocyclyl) methanol and (1-phenyl-1-heterocyclyl) methylamine derivatives ASTRA AB (SE) 1996-07-17 CN claimed
EP-0707574-A1 NOVEL (1-PHENYL-1-HETEROCYCLYL)METHANOL AND (1-PHENYL-1-HETEROCYCLYL)METHYLAMINE DERIVATIVES Astra Aktiebolag (SE) 1996-04-24 EP claimed
WO-1995001968-A1 NOVEL (1-PHENYL-1-HETEROCYCLYL)METHANOL AND (1-PHENYL-1-HETEROCYCLYL)METHYLAMINE DERIVATIVES ASTRA AKTIEBOLAG (SE) 1995-01-19 WO claimed
CN-1047169-C (1-phenyl-1-heterocyclyl) methanol and (1-phenyl-1-heterocyclyl) methylamine derivatives ASTRA AB (SE) 1999-12-08 CN disclosed
US-5712299-A TREATMENT OF NEURODEGENERATIVE DISORDERS ASTRA AKTIEBOLAG (SE) 1998-01-27 US disclosed
CN-1126991-A Novel (1-phenyl-1-heterocyclyl) methanol and (1-phenyl-1-heterocyclyl) methylamine derivatives ASTRA AB (SE) 1996-07-17 CN disclosed
EP-0707574-A1 NOVEL (1-PHENYL-1-HETEROCYCLYL)METHANOL AND (1-PHENYL-1-HETEROCYCLYL)METHYLAMINE DERIVATIVES Astra Aktiebolag (SE) 1996-04-24 EP disclosed
WO-1995001968-A1 NOVEL (1-PHENYL-1-HETEROCYCLYL)METHANOL AND (1-PHENYL-1-HETEROCYCLYL)METHYLAMINE DERIVATIVES ASTRA AKTIEBOLAG (SE) 1995-01-19 WO disclosed