SCHEMBL27607461

SCHEMBL27607461

Cc1ccc(S(=O)(=O)OCCc2csc(-c3ccncc3C)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.44
MAPT P10636 4/20 0.43
LMNA P02545 4/20 0.43
KDM4E B2RXH2 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 3/20 0.41
RAB9A P51151 1/20 0.41
GAA P10253 1/20 0.41
TP53 P04637 4/20 0.41
KMT2A Q03164 2/20 0.39
ADRB2 P07550 1/20 0.38
MEN1 O00255 1/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL27607474 0.82 LMNA (0.46) MAPTLMNAKDM4ESMN1; SMN2ALDH1A1
SCHEMBL6800670 0.80 KMT2A (0.56) MAPTLMNASMN1; SMN2ALDH1A1RAB9A
SCHEMBL15456206 0.74 LMNA (0.41) MAPTLMNAKDM4ESMN1; SMN2ALDH1A1
SCHEMBL4893501 0.70 PPARA (0.44) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL1897457 0.70 PKM (0.47) KDM4EALDH1A1KMT2AMEN1TSHR
SCHEMBL6796094 0.70 SLC6A3 (0.46) MAPTLMNASMN1; SMN2ALDH1A1GAA
SCHEMBL7037973 0.69 PSMD10 (0.39) LMNASMN1; SMN2ALDH1A1KMT2AHTT
SCHEMBL6800933 0.69 SIRT1 (0.44) MAPTLMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL1607077 0.68 ALDH1A1 (0.47) MAPTLMNAKDM4ESMN1; SMN2ALDH1A1
SCHEMBL30018427 0.68 ALDH1A1 (0.47) MAPTLMNAKDM4ESMN1; SMN2ALDH1A1

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
CN-1578659-A Modulators of peroxisome proliferator activated receptors (ppar) LILLY CO ELI (US) 2005-02-09 CN disclosed