SCHEMBL20619615

SCHEMBL20619615

O=Cc1ccc(NC(=O)c2cc(C(F)F)cnc2N2CC3(CCOCC3)C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 8/20 0.37
▸ PDE4B Q07343 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ ABL1 P00519 1/20 0.34
▸ KCNQ3 O43525 1/20 0.34
▸ KCNQ2 O43526 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34

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
SCHEMBL20619600 0.87 SCN10A (0.42) SCN10APDE4BMAPTLMNATP53
SCHEMBL24187946 0.84 BACE1 (0.37) SCN10APDE4BMAPTBACE1ALDH1A1
SCHEMBL24187976 0.84 LMNA (0.43) SCN10APDE4BMAPTLMNATP53
SCHEMBL20620052 0.82 ALDH1A1 (0.48) MAPTALDH1A1
SCHEMBL20619503 0.81 HCK (0.38) MAPTLMNAALDH1A1
SCHEMBL20619918 0.77 SCN10A (0.41) SCN10APDE4BMAPTALDH1A1
SCHEMBL20598038 0.74 SCN10A (0.42) SCN10AMAPTTP53ALDH1A1
SCHEMBL20619496 0.74 SCN10A (0.42) SCN10APDE4BMAPTABL1TP53
SCHEMBL20597986 0.73 MAPK1 (0.42) SCN10AMAPTTP53ALDH1A1
SCHEMBL20619910 0.72 MAPT (0.41) SCN10AMAPTLMNATP53ALDH1A1

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
WO-2019006295-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2019-01-03 — — WO disclosed
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