SCHEMBL6159636

SCHEMBL6159636

C#Cc1[c]cccc1Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
LTA4H P09960 1/20 0.38
GAA P10253 2/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
DPP4 P27487 1/20 0.38
HRH1 P35367 1/20 0.36
CTNNB1 P35222 1/20 0.36
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 3/20 0.35
ALDH1A1 P00352 2/20 0.35
RIPK1 Q13546 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 2/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM1A O60341 2/20 0.34
HTR1A P08908 2/20 0.34
SLC6A3 Q01959 2/20 0.34
NR1H2 P55055 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
SCHEMBL9498629 0.82 GAA (0.41) TSHRLTA4HGAALMNAKMT2A
SCHEMBL3221282 0.76 CA1 (0.41) TSHRLMNAALDH1A1HPGDHTT
SCHEMBL983525 0.73 TSHR (0.44) TSHRLTA4HGAALMNAKMT2A
SCHEMBL920807 0.72 TSHR (0.42) TSHRLTA4HGAALMNAKMT2A
SCHEMBL9685460 0.72 DPP4 (0.44) TSHRLTA4HGAALMNAKMT2A
SCHEMBL14695561 0.72 LTA4H (0.43) TSHRLTA4HGAALMNAKMT2A
SCHEMBL5903538 0.72 TSHR (0.42) TSHRLTA4HGAALMNAKMT2A
SCHEMBL2091154 0.72 TSHR (0.42) TSHRLTA4HGAALMNAKMT2A
SCHEMBL16953959 0.71 DRD1 (0.32) KMT2AALDH1A1
SCHEMBL2168004 0.71 DPP4 (0.41) TSHRLTA4HGAALMNAKMT2A

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
EP-1434772-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2005-05-04 EP disclosed
EP-1434772-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2004-07-07 EP disclosed
WO-2003031434-A1 COMPOUNDS AND METHODS SMITH KLINE BEECHAM CORPORATION (US) 2003-04-17 WO disclosed