SCHEMBL23958674

SCHEMBL23958674

CCNC(C)(C)c1c(F)c(-c2ccc(F)cc2)nc(C(O)(CN)C(F)(F)F)c1F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CFTR P13569 3/20 0.34
TNIK Q9UKE5 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
GPR55 Q9Y2T6 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PKM P14618 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
SCHEMBL23958729 0.86 CFTR (0.35) CFTRTNIKMEN1MAPTKMT2A
SCHEMBL30006775 0.86 CFTR (0.35) CFTRTNIKMEN1MAPTKMT2A
SCHEMBL23958643 0.86 CFTR (0.35) CFTRTNIKMEN1MAPTKMT2A
SCHEMBL23958689 0.86 CFTR (0.35) CFTRTNIKMEN1MAPTKMT2A
SCHEMBL25686809 0.85 CFTR (0.37) CFTRLMNAMEN1MAPTKMT2A
SCHEMBL23958631 0.85 CFTR (0.37) CFTRLMNAMEN1MAPTKMT2A
SCHEMBL23958727 0.85 CFTR (0.37) CFTRLMNAMEN1MAPTKMT2A
SCHEMBL23958789 0.84 CFTR (0.35) CFTRLMNA
SCHEMBL25686843 0.84 CFTR (0.35) CFTRLMNA
SCHEMBL25686838 0.84 CFTR (0.35) CFTRLMNA

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