SCHEMBL21976239

SCHEMBL21976239

O=C(c1ccc(NSc2cc(F)cc3cccnc23)cc1)N1CCC(O)(c2ccccc2)CC1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PKLR P30613 20/20 0.70

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
SCHEMBL21976363 0.90 PKLR (0.67) PKLR
SCHEMBL21975972 0.90 PKLR (0.70) PKLR
SCHEMBL21976023 0.88 PKLR (0.73) PKLR
SCHEMBL21976318 0.88 PKLR (0.70) PKLR
SCHEMBL21976235 0.88 PKLR (0.69) PKLR
SCHEMBL21975977 0.83 PKLR (0.70) PKLR
SCHEMBL16049649 0.82 PKLR (1.00) PKLR
SCHEMBL21976370 0.82 PKLR (0.71) PKLR
SCHEMBL21975963 0.81 PKLR (0.70) PKLR
SCHEMBL21976374 0.81 PKLR (0.69) PKLR

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-2970189-B1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS AGIOS PHARMACEUTICALS INC (US) 2020-05-06 — — EP disclosed
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