SCHEMBL23958856

SCHEMBL23958856

CC(C)(O)c1cc(C(CN)C2CC2)nc(-c2ccc(Cl)cc2)c1F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.30
ACHE P22303 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
SCHEMBL23958627 0.91 CFTR (0.36)
SCHEMBL23958709 0.89 FFAR1 (0.31)
SCHEMBL23958778 0.88 DGAT1 (0.33)
SCHEMBL23958741 0.84 TACR3 (0.35)
SCHEMBL23958732 0.83
SCHEMBL23958681 0.81 CFTR (0.32) PGR
SCHEMBL23958688 0.81 CFTR (0.32) PGR
SCHEMBL23958793 0.79 CFTR (0.35)
SCHEMBL23958893 0.77 MAPK1 (0.32)
SCHEMBL23958854 0.75 PRKACA (0.33) PGRACHE

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-2021214136-A1 RSV INHIBITING 3-SUBSTITUTED QUINOLINE AND CINNOLINE DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2021-10-28 WO disclosed