SCHEMBL7201619

SCHEMBL7201619

CN(C)OCCO[C@]1([SiH](c2ccccc2)c2ccccc2)[C@H](O)[C@@H](COC(C)(C)C)O[C@@]1(C)n1ccc(=O)[nH]c1=O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL3567690 0.74 P2RY6 (0.35) P2RY14
SCHEMBL5960168 0.73 P2RY14 (0.33) P2RY14
SCHEMBL8205228 0.71 DUT (0.32) P2RY14
SCHEMBL3577226 0.71 DUT (0.31)
SCHEMBL3516066 0.70 TK2 (0.32)
SCHEMBL7901421 0.69 TK1 (0.32)
SCHEMBL2515798 0.68 P2RY6 (0.34) P2RY14CYP3A4CYP2C9
SCHEMBL3514646 0.67 P2RY6 (0.33)
SCHEMBL9218584 0.67 P2RY2 (0.40) P2RY14
Methylene Chloride SCHEMBL4340806 0.66 P2RY2 (0.32)

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
US-6602857-B1 Antisense modulation of PTP1B expression ISIS PHARMACEUTICALS, INC. 2003-08-05 US disclosed