SCHEMBL19966841

SCHEMBL19966841

CCCc1cc(SF)cnc1Cl

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL26029258 0.77 PLAU (0.34) ALDH1A1NPSR1
SCHEMBL25442362 0.71 PPARG (0.33) ALDH1A1NPSR1
SCHEMBL13040092 0.68 KEAP1 (0.40)
SCHEMBL20124858 0.66
SCHEMBL6219173 0.66 AURKA (0.34) ALDH1A1
SCHEMBL27371741 0.66 CTRC (0.39) ALDH1A1NPSR1
SCHEMBL197804 0.64 ALOX5 (0.39)
SCHEMBL30500471 0.63 TDP1 (0.41) ALDH1A1
SCHEMBL7832945 0.63 TDP1 (0.41) ALDH1A1
SCHEMBL13548295 0.63 RAB9A (0.45) ALDH1A1NPSR1

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-2018047109-A1 POLYCYCLIC PYRIDONE COMPOUNDS AS ANTIVIRALS NOVARTIS AG (CH) 2018-03-15 WO disclosed