SCHEMBL8611161

SCHEMBL8611161

COc1cc2nc(S(=O)(=O)Nc3c(F)ccc4cccnc34)nn2c(OC)n1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 9/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GLO1 Q04760 1/20 0.38
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL8612969 0.91 SLC40A1 (0.43) SLC40A1MEN1KMT2AGLO1ALDH1A1
SCHEMBL9535324 0.78 TSHR (0.42) TSHR
SCHEMBL8352235 0.75 TSHR (0.42) SLC40A1KMT2ATSHR
SCHEMBL910274 0.75 GAA (0.42) SLC40A1KMT2ATSHR
SCHEMBL8890841 0.75 TSHR (0.35) SLC40A1ALDH1A1TSHR
SCHEMBL909656 0.73 TSHR (0.36) ALDH1A1TSHR
SCHEMBL8881879 0.71 TSHR (0.34) TSHR
SCHEMBL8113170 0.70 TSHR (0.39) TSHR
SCHEMBL7849670 0.70 GAA (0.44) SLC40A1KMT2ATSHR
SCHEMBL9035985 0.70 SLC40A1 (0.37) SLC40A1MEN1KMT2AGLO1ALDH1A1

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-1998030564-A1 SULFONAMIDE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1998-07-16 WO disclosed