SCHEMBL19983965

SCHEMBL19983965

CN1C=CC=C(Sn2cc(C(=O)N(C)C)c3ccc(Nc4ccc(OC(F)(F)F)cc4Cl)cc32)C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.33
FBP1 P09467 2/20 0.32
IDH1 O75874 15/20 0.32
ABL1 P00519 1/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL19983939 0.72 ABL1 (0.37) ABL1
SCHEMBL16619188 0.71 LMNA (0.40) LRRK2FBP1ABL1
SCHEMBL19984057 0.64 AKR1C3 (0.35) LRRK2
SCHEMBL19983885 0.63 FBP1 (0.39) FBP1ABL1
SCHEMBL16618640 0.61 LMNA (0.41) FBP1ABL1
SCHEMBL19983961 0.61 DHODH (0.37)
SCHEMBL19983946 0.61 SLC6A4 (0.38) FBP1ABL1
SCHEMBL17971590 0.61 FBP1 (0.47) FBP1
SCHEMBL19983775 0.60 EGFR (0.34) FBP1
SCHEMBL19983934 0.60 TUBB1 (0.41)

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
EP-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP disclosed