SCHEMBL5746293

SCHEMBL5746293

CC(C)c1ccc(C(=O)C(C)(O)CCC(C)(O)C(=O)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP5 P45974 1/20 0.46
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
CYP2C9 P11712 2/20 0.45
CYP2D6 P10635 1/20 0.45
HIF1A Q16665 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
CNR2 P34972 1/20 0.41
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
SRC P12931 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
KIF11 P52732 1/20 0.40
EGFR P00533 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
MLYCD O95822 1/20 0.39

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
SCHEMBL14762304 0.88 RAB9A (0.52) USP5RAB9ANPC1CYP2C9CYP2D6
SCHEMBL11292363 0.86 CES1 (0.50) RAB9ANPC1HIF1ASMN1; SMN2POLB
SCHEMBL1409972 0.85 CYP2C9 (0.49) USP5RAB9ANPC1CYP2C9CYP2D6
SCHEMBL1618561 0.84 RAB9A (0.50) USP5RAB9ANPC1CYP2C9CYP2D6
SCHEMBL4453109 0.83 USP5 (0.47) USP5RAB9ANPC1CYP2C9CYP2D6
SCHEMBL22660971 0.81 USP5 (0.46) USP5RAB9ANPC1CYP2C9CYP2D6
Benzophenone SCHEMBL11101215 0.81 ALDH1A1 (0.45) USP5RAB9ANPC1CYP2C9CYP2D6
Benzil SCHEMBL29000475 0.81 CES2 (0.48) USP5RAB9ANPC1CYP2C9CYP2D6
SCHEMBL11889616 0.79 USP5 (0.42) USP5RAB9ANPC1CYP2C9CYP2D6
SCHEMBL5705634 0.78 THRA (0.48)

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
EP-1729043-A1 Gasket integrated with cover BRIDGESTONE CORPORATION (JP) 2006-12-06 EP disclosed
EP-0239641-A1 DI(METH)ACRYLIC ESTERS AND RESIN COMPOSITION NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1987-10-07 EP disclosed