SCHEMBL7131978

SCHEMBL7131978

CC(C)(C)[Si](C)(C)OC1C[C@H](C(=O)O)N(C(=O)OCc2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
PDK1 Q15118 1/20 0.43
PDK2 Q15119 1/20 0.43
PDK3 Q15120 1/20 0.43
PDK4 Q16654 1/20 0.43
AGTR2 P50052 3/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PREP P48147 2/20 0.41
HTR2C P28335 1/20 0.40

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
SCHEMBL820890 1.00 POLB (0.43) POLBPDK1PDK2PDK3PDK4
SCHEMBL7488827 1.00 POLB (0.43) POLBPDK1PDK2PDK3PDK4
SCHEMBL7122244 1.00 POLB (0.43) POLBPDK1PDK2PDK3PDK4
SCHEMBL819549 1.00 POLB (0.43) POLBPDK1PDK2PDK3PDK4
SCHEMBL19132495 0.93 POLB (0.43) POLBPDK1PDK2PDK3PDK4
SCHEMBL29993610 0.93 POLB (0.45) POLBPDK1PDK2PDK3PDK4
SCHEMBL29830276 0.93 POLB (0.45) POLBPDK1PDK2PDK3PDK4
SCHEMBL20666655 0.91 POLB (0.43) POLBPDK1PDK2PDK3PDK4
SCHEMBL9640980 0.91 POLB (0.43) POLBPDK1PDK2PDK3PDK4
SCHEMBL28747 0.91 POLB (0.43) POLBPDK1PDK2PDK3PDK4

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-6660759-B1 4.5-diaryloxazole compounds with prostaglandin I2 (PGI2) agonistic activity FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-12-09 US disclosed
EP-1208099-A1 4,5-DIARYLOXAZOLE COMPOUNDS WITH PROSTAGLANDIN I2 (PGI2) AGONISTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-05-29 EP disclosed
WO-2001016132-A1 4,5-DIARYLOXAZOLE COMPOUNDS WITH PROSTAGLANDIN 12 (PG12) AGONISTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-08 WO disclosed