SCHEMBL16626624

SCHEMBL16626624

CNCc1cn([S+]([O-])c2cccnc2)c2cc(Cc3ccc(C)cc3F)ccc12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NAMPT P43490 1/20 0.31
RAB9A P51151 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
SCHEMBL16626650 0.90 SLC6A4 (0.33) NAMPT
SCHEMBL16626750 0.89 RAB9A (0.36) KDM4ENAMPTRAB9A
SCHEMBL19984028 0.89 ALDH1A1 (0.37) KDM4ENAMPT
SCHEMBL16626783 0.85 P2RX7 (0.35) KDM4ENAMPT
SCHEMBL16626644 0.82 CYP11B1 (0.37) NAMPT
SCHEMBL19983950 0.80 CYP11B1 (0.41) RAB9A
SCHEMBL19984136 0.79 MEN1 (0.39) NAMPT
SCHEMBL19984004 0.79 MEN1 (0.32) KDM4ENAMPT
SCHEMBL19983960 0.79 CYP11B1 (0.36) NAMPT
SCHEMBL16626433 0.79 EGFR (0.33)

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-2015050412-A1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2015-04-09 WO disclosed