SCHEMBL6824596

SCHEMBL6824596

OC(Oc1ccccn1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
CYP2D6 P10635 1/20 0.41
KDM4E B2RXH2 6/20 0.39
CYP1A2 P05177 2/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 4/20 0.38
POLB P06746 2/20 0.38
P4HTM Q9NXG6 2/20 0.38
CCR1 P32246 1/20 0.38
CCR5 P51681 1/20 0.38
CCR8 P51685 1/20 0.38
METAP1 P53582 1/20 0.38
BLM P54132 1/20 0.38
HIF1A Q16665 1/20 0.38
DOHH Q9BU89 1/20 0.38
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37

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
SCHEMBL27898638 0.80 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3CYP2D6KDM4E
SCHEMBL28626450 0.80 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3CYP2D6KDM4E
SCHEMBL21494388 0.77 ADRA2A (0.47) SLC6A2SLC6A4SLC6A3KDM4ECYP1A2
SCHEMBL11191009 0.77 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3CYP2D6KDM4E
SCHEMBL4611560 0.77 PPARA (0.43) SLC6A2SLC6A4SLC6A3CYP2D6KDM4E
SCHEMBL21881598 0.77 PPARA (0.43) SLC6A2SLC6A4SLC6A3CYP2D6KDM4E
SCHEMBL11001241 0.76 SMN1; SMN2 (0.41) KDM4ECYP1A2ALDH1A1LMNAPOLB
SCHEMBL8787698 0.74 CYP2D6 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6KDM4E
SCHEMBL5521719 0.73 LMNA (0.44) CYP2D6KDM4ECYP1A2ALDH1A1LMNA
SCHEMBL6965784 0.73 NOS2 (0.45) SLC6A2SLC6A4SLC6A3CYP1A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004087667-A1 ESTER DERIVATIVES OF (PYRIDINYLOXY-PHENYL)-METHANOL AND PROCESS OF PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-10-14 WO claimed
WO-2004087667-A1 ESTER DERIVATIVES OF (PYRIDINYLOXY-PHENYL)-METHANOL AND PROCESS OF PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-10-14 WO disclosed
WO-2004087667-A1 ESTER DERIVATIVES OF (PYRIDINYLOXY-PHENYL)-METHANOL AND PROCESS OF PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-10-14 WO disclosed