SCHEMBL28087618

SCHEMBL28087618

O=C(O)C1(C(=O)O)CCCCC1.O=C(O)CCCCCCCCCCCCC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
LMNA P02545 3/20 0.52
NFKB1 P19838 1/20 0.52
PMP22 Q01453 1/20 0.52
GPR84 Q9NQS5 8/20 0.44
FFAR1 O14842 2/20 0.44
FFAR4 Q5NUL3 2/20 0.44
CYP2C19 P33261 1/20 0.43
PPARG P37231 6/20 0.43
PPARD Q03181 6/20 0.43
PPARA Q07869 6/20 0.43
HDAC11 Q96DB2 5/20 0.43
ALDH1A1 P00352 3/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MEN1 O00255 2/20 0.43
FABP4 P15090 2/20 0.43
ALOX15 P16050 2/20 0.43
PTPN1 P18031 2/20 0.43
KMT2A Q03164 2/20 0.43

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
Adipic Acid SCHEMBL27348845 0.98 LMNA (0.50) TSHRLMNANFKB1PMP22GPR84
SCHEMBL1202607 0.93 TSHR (0.55) TSHRLMNANFKB1PMP22GPR84
Succinic Acid SCHEMBL28153397 0.89 CYP2C19 (0.48) TSHRLMNANFKB1PMP22CYP2C19
Adipic Acid SCHEMBL6854347 0.85 KDM4A (0.38) TSHRLMNANFKB1PMP22GPR84
Adipic Acid SCHEMBL4361110 0.84 AKR1B1 (0.39) TSHRLMNANFKB1PMP22GPR84
Adipic Acid SCHEMBL6847194 0.84 CYP1A2 (0.44) TSHRLMNANFKB1PMP22GPR84
SCHEMBL518477 0.81 CYP2C19 (0.46) TSHRLMNACYP2C19ALDH1A1
SCHEMBL11214274 0.81 CYP2C19 (0.46) TSHRLMNACYP2C19ALDH1A1
SCHEMBL25741 0.81 CYP2C19 (0.46) TSHRLMNACYP2C19ALDH1A1
SCHEMBL5509416 0.81 CYP2C19 (0.46) TSHRLMNACYP2C19ALDH1A1

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
CN-108368276-A Polyester resin composition and its manufacturing method, formed body and its manufacturing method and masterbatch 三菱瓦斯化学株式会社 2018-08-03 CN disclosed
CN-105849189-B Polyester resin composition and the formed body for having used the resin combination 三菱瓦斯化学株式会社 2018-07-17 CN disclosed
CN-105849189-A Polyester-based resin composition, and molded body using the resin composition 三菱瓦斯化学株式会社 2016-08-10 CN disclosed