SCHEMBL4449795

SCHEMBL4449795

O=C(O)CCCCCOc1ccc(-c2cc(Cl)c(Cl)cc2Cl)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.49
FFAR4 Q5NUL3 4/20 0.49
RAB9A P51151 1/20 0.48
FABP4 P15090 2/20 0.45
LTB4R Q15722 2/20 0.45
PPARG P37231 2/20 0.44
CYP2C9 P11712 1/20 0.44
SCN5A Q14524 1/20 0.44
AHR P35869 1/20 0.44
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
PPARA Q07869 1/20 0.41
PRKAB2 O43741 1/20 0.41
PRKAG1 P54619 1/20 0.41
PRKAA2 P54646 1/20 0.41

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
SCHEMBL4451807 0.87 RAB9A (0.51) FFAR1FFAR4RAB9AFABP4LTB4R
SCHEMBL5339875 0.81 LMNA (0.49) RAB9ALTB4RPPARGTDP1THRA
SCHEMBL10381113 0.80 RAB9A (0.70) FFAR1RAB9AMAPTTDP1ALDH1A1
SCHEMBL10382178 0.80 RAB9A (0.70) FFAR1RAB9AMAPTTDP1ALDH1A1
SCHEMBL28078479 0.80 LTB4R (0.42) FFAR1FFAR4RAB9AFABP4LTB4R
SCHEMBL10381793 0.78 RAB9A (0.72) FFAR1RAB9AMAPTTDP1ALDH1A1
SCHEMBL20230373 0.77 PPARG (0.68) FFAR1FFAR4RAB9APPARGCYP2C9
SCHEMBL13244187 0.77 RAB9A (0.56) RAB9ALTB4RPPARGMAPTTDP1
SCHEMBL20231597 0.77 PPARG (0.49) RAB9AFABP4PPARGMAPTTDP1
SCHEMBL9322243 0.75 MEN1 (0.55) RAB9ALTB4RMAPTTDP1ALDH1A1

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
US-20090269857-A1 Instruments for detecting low-molecular weight substance FUJIKURA KASEI CO., LTD. (JP) 2009-10-29 US disclosed
US-20050148097-A1 Instruments for detecting low-molecular weight substance ENBIOTEC LABORATORIES C., LTD. (JP) 2005-07-07 US disclosed
EP-1489420-A1 INSTRUMENTS FOR DETECTING LOW-MOLECULAR WEIGHT SUBSTANCE Enbiotec Laboratories Co., Ltd. (JP) 2004-12-22 EP disclosed