SCHEMBL10587121

SCHEMBL10587121

Cc1ccc(S(=O)(=O)c2c[nH]nn2)c(C)c1C

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
TSHR P16473 2/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
PKM P14618 1/20 0.36
CYP2C19 P33261 1/20 0.36
NR2F2 P24468 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL8654400 0.74 ALDH1A1 (0.47) ALDH1A1TSHRKMT2AMEN1CYP1A2
SCHEMBL1976807 0.71 GAA (0.52) ALDH1A1KMT2AMEN1PKML3MBTL1
SCHEMBL1763070 0.70 RAPGEF4 (0.44) ALDH1A1KMT2AMEN1NR2F2L3MBTL1
SCHEMBL12854186 0.67 PSIP1 (0.32)
SCHEMBL6820319 0.67 HTR6 (0.48) ALDH1A1TSHRPKMLMNAKDM4E
SCHEMBL4947200 0.67
SCHEMBL21621365 0.66 SMN1; SMN2 (0.35) ALDH1A1L3MBTL1LMNA
SCHEMBL8199101 0.66 AKR1B1 (0.30)
SCHEMBL10634639 0.65 HTR6 (0.50) ALDH1A1TSHRKMT2AMEN1PKM
SCHEMBL14030962 0.65 GAA (0.58) ALDH1A1KMT2AMEN1PKMKDM4E

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-0331032-A1 2'-Deoxy-5-fluorouridine derivatives TAIHO PHARMACEUTICAL CO., LTD. (JP) 1989-09-06 EP disclosed