SCHEMBL6616547

SCHEMBL6616547

CC(Br)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
PTGS1 P23219 1/20 0.56
SLC6A2 P23975 1/20 0.56
CYP2C19 P33261 1/20 0.56
PTGS2 P35354 1/20 0.56
SLC6A3 Q01959 1/20 0.56
HIF1A Q16665 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
ALOX5 P09917 1/20 0.55
MAOB P27338 4/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
MAOA P21397 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
BCHE P06276 2/20 0.54
LTA4H P09960 1/20 0.51
EPHX2 P34913 1/20 0.51

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
SCHEMBL27899027 0.93 APP (0.55) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL683554 0.85 RXRA (0.66) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8762019 0.85 LMNA (0.60) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL31185919 0.84 RRM1 (0.53) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL2023883 0.84 LMNA (0.58) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL7331392 0.83 LMNA (0.53) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL5175359 0.83 NPC1 (0.57) RAB9ALTA4H
SCHEMBL11212210 0.83 BCHE (0.58) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL4065480 0.82 LMNA (0.57) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL7288111 0.82 LMNA (0.56) LMNACYP1A2PTGS1SLC6A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103980235-A GPR120 receptor agonists and uses thereof CYMABAY THERAPEUTICS INC 2014-08-13 CN disclosed
CN-102307860-B GPR120 receptor agonists and uses thereof METABOLEX INC 2014-07-02 CN disclosed
CN-102307860-A GPR120 receptor agonists and uses thereof METABOLEX INC 2012-01-04 CN disclosed
EP-1446388-A1 1,2,4-TRIAZOLE DERIVATIVES CONTAINING A SULPHAMATE GROUP AS AROMATASE INHIBITORS Sterix Limited (GB) 2004-08-18 EP disclosed
WO-2003045925-A1 1,2,4-TRIAZOLE DERIVATIVES CONTAINING A SULPHAMATE GROUP AS AROMATASE INHIBITORS STERIX LIMITED (GB) 2003-06-05 WO disclosed