SCHEMBL25802928

SCHEMBL25802928

[O-][S+](c1ccccc1)n1c(I)cc2c(Cl)ccnc21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ENPP3 O14638 2/20 0.32
▸ ENPP1 P22413 2/20 0.32
▸ AXL P30530 1/20 0.30
▸ PRKCI P41743 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
SCHEMBL18380996 1.00 ENPP3 (0.32) ENPP3ENPP1AXLPRKCI
SCHEMBL21251024 0.87 POLB (0.32) —
SCHEMBL18380981 0.81 PDE4A (0.35) —
SCHEMBL14520640 0.73 ENPP3 (0.41) ENPP3ENPP1
SCHEMBL15586643 0.69 ENPP3 (0.33) ENPP3ENPP1
SCHEMBL21251023 0.68 KDM4E (0.32) —
SCHEMBL2043856 0.68 PIM1 (0.46) ENPP3ENPP1AXLPRKCI
SCHEMBL30751165 0.68 ENPP3 (0.44) ENPP3ENPP1
SCHEMBL5661951 0.68 ENPP3 (0.44) ENPP3ENPP1
SCHEMBL5663011 0.66 PTGDR2 (0.39) ENPP3ENPP1AXLPRKCI

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
EP-3152210-B1 TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES INC (US) 2023-07-05 — — EP disclosed
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