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Sugi Predict / Compounds / SCHEMBL20538716

SCHEMBL20538716

SCHEMBL20538716

CC(CO)NC(=O)c1cc(C(F)(F)F)ccc1-c1ccc(-c2cnc(N)cn2)c(F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ FEN1 P39748 20/20 1.00
▸ ALOX5AP P20292 19/20 1.00

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
SCHEMBL15917144 1.00 FEN1 (1.00) FEN1ALOX5AP
SCHEMBL15917508 1.00 FEN1 (1.00) FEN1ALOX5AP
SCHEMBL15917535 0.89 FEN1 (1.00) FEN1ALOX5AP
SCHEMBL20607611 0.89 FEN1 (1.00) FEN1ALOX5AP
SCHEMBL15917531 0.89 FEN1 (1.00) FEN1ALOX5AP
SCHEMBL20538667 0.87 ALOX5AP (1.00) FEN1ALOX5AP
SCHEMBL15915354 0.87 ALOX5AP (1.00) FEN1ALOX5AP
SCHEMBL15915975 0.87 ALOX5AP (1.00) FEN1ALOX5AP
SCHEMBL15917306 0.85 FEN1 (1.00) FEN1ALOX5AP
SCHEMBL20627441 0.85 FEN1 (0.75) FEN1ALOX5AP

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3070085-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-01-09 — — EP claimed
EP-3495359-A1 FLAP MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-12 — — EP disclosed
EP-3070085-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-01-09 — — EP disclosed
EP-3070085-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-01-09 — — EP disclosed
EP-2951170-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-10-24 — — EP disclosed