SCHEMBL28067401

SCHEMBL28067401

O=C(O)c1ccccc1-c1ccc(COCc2ccc(-c3ccccc3C(=O)O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 11/20 0.56
BRS3 P32247 2/20 0.50
LPAR1 Q92633 1/20 0.50
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
RXRG P48443 1/20 0.49
FOLH1 Q04609 1/20 0.49

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
SCHEMBL6576560 0.91 LTB4R2 (0.51) LTB4R2BRS3LPAR1
SCHEMBL28358608 0.87 LTB4R2 (0.57) LTB4R2LPAR1
SCHEMBL30466597 0.85 BCAT2 (0.62) LTB4R2RXRARXRBRXRG
SCHEMBL28067445 0.84 RXRA (0.62) LTB4R2RXRARXRBRXRGFOLH1
SCHEMBL22227462 0.84 LTB4R2 (0.51) LTB4R2BRS3LPAR1RXRARXRB
SCHEMBL5151244 0.84 LTB4R2 (0.60) LTB4R2BRS3LPAR1FOLH1
SCHEMBL18759613 0.83 HNF4A (0.63) LTB4R2
SCHEMBL30292805 0.83 HNF4A (0.63) LTB4R2
SCHEMBL6799282 0.82 MCL1 (0.63)
SCHEMBL22227471 0.82 LTB4R2 (0.49) LTB4R2BRS3LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107522722-A A kind of two-fold penetration Zn (II) complex available for inkless and erasable printing and preparation method thereof 淮阴师范学院 2017-12-29 CN disclosed
CN-105732669-A Dicaboxylic acid ligand silver complex and preparation method and application thereof 曲阜师范大学 2016-07-06 CN disclosed