SCHEMBL28065708

SCHEMBL28065708

CCCCC(CC)CC(Br)CCCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
TDP1 Q9NUW8 3/20 0.46
CYP3A4 P08684 1/20 0.46
ATM Q13315 1/20 0.46
CA2 P00918 2/20 0.46
AKR1B1 P15121 1/20 0.44
GPR84 Q9NQS5 7/20 0.42
PPARG P37231 7/20 0.42
PPARD Q03181 7/20 0.42
PPARA Q07869 7/20 0.42
HDAC11 Q96DB2 5/20 0.42
PTPN1 P18031 3/20 0.42
ALDH1A1 P00352 3/20 0.42
TLR2 O60603 2/20 0.42
FABP4 P15090 2/20 0.42
FFAR1 O14842 2/20 0.42
FFAR4 Q5NUL3 2/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL28065652 0.92 TSHR (0.47) TSHRTDP1CYP3A4ATMCA2
SCHEMBL16440018 0.86 CA2 (0.52) TSHRTDP1CYP3A4ATMCA2
SCHEMBL2960157 0.84 CA2 (0.62) TSHRTDP1CYP3A4ATMCA2
SCHEMBL10422257 0.80 CA2 (0.46) TSHRTDP1CYP3A4ATMCA2
SCHEMBL991396 0.80 CA2 (0.56) TSHRTDP1CYP3A4ATMCA2
SCHEMBL34464730 0.80 ALDH1A1 (0.46) TSHRTDP1CYP3A4ATMCA2
SCHEMBL24638178 0.80 AKR1B1 (0.61) TSHRTDP1AKR1B1GPR84PPARG
SCHEMBL5878918 0.78 CA2 (0.60) TSHRTDP1CYP3A4ATMCA2
SCHEMBL9361529 0.78 FFAR4 (0.60) TSHRTDP1AKR1B1GPR84PPARG
SCHEMBL16213046 0.78 FFAR4 (0.60) TSHRTDP1CA2AKR1B1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103460086-B Color composition for color filter and colour filter TOYO INK SC HOLDINGS CO.,LTD. (JP) 2016-05-18 CN disclosed