SCHEMBL20879436

SCHEMBL20879436

CC(C)(C)[Si](C)(C)OC[C@]1(CCl)CC[C@H](n2ccc(=O)[nH]c2=O)O1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DUT P33316 6/20 0.48
▸ P2RY6 Q15077 1/20 0.33
▸ TOP2A P11388 5/20 0.32
▸ P2RY2 P41231 2/20 0.31
▸ P2RY4 P51582 2/20 0.31
▸ SLC28A1 O00337 1/20 0.31
▸ SLC28A2 O43868 1/20 0.31
▸ SLC29A1 Q99808 1/20 0.31
▸ SLC28A3 Q9HAS3 1/20 0.31
▸ EHMT2 Q96KQ7 2/20 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
SCHEMBL20879386 0.94 DUT (0.51) DUTP2RY6TOP2AP2RY2P2RY4
SCHEMBL22666153 0.90 DUT (0.48) DUTP2RY6TOP2AP2RY2P2RY4
SCHEMBL25567944 0.87 DUT (0.46) DUTP2RY6TOP2A
SCHEMBL22241508 0.85 DUT (0.43) DUTP2RY6TOP2AP2RY2P2RY4
SCHEMBL22666158 0.84 DUT (0.43) DUT
SCHEMBL24928459 0.84 DUT (0.49) DUTP2RY6TOP2AP2RY2P2RY4
SCHEMBL22110552 0.81 DUT (0.47) DUTP2RY6TOP2AP2RY2P2RY4
SCHEMBL20879483 0.81 PDE3A (0.39) DUTSLC29A1
SCHEMBL21152287 0.81 DUT (0.45) DUTP2RY6P2RY2P2RY4SLC28A1
SCHEMBL25576488 0.80 DUT (0.46) DUTP2RY6P2RY2P2RY4

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-3013340-B1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF JANSSEN BIOPHARMA INC (US) 2023-06-07 — — EP disclosed
EP-3466959-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen BioPharma, Inc. (US) 2019-04-10 — — EP disclosed
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