SCHEMBL4556658

SCHEMBL4556658

COc1cc(S(=O)(=O)Nc2ccccc2)cc2ccc(O)cc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.58
▸ CA9 Q16790 1/20 0.58
▸ HCRTR1 O43613 1/20 0.51
▸ HTT P42858 3/20 0.50
▸ PLAU P00749 1/20 0.48
▸ PTGES O14684 1/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ HSP90AA1 P07900 1/20 0.46
▸ HSP90AB1 P08238 1/20 0.46
▸ ALOX12 P18054 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ HSD17B2 P37059 1/20 0.44
▸ LMNA P02545 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GPR27 Q9NS67 2/20 0.44
▸ AVPR2 P30518 1/20 0.44
▸ UQCRB P14927 1/20 0.44

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
SCHEMBL4554800 0.90 CA12 (0.58) CA12CA9HCRTR1HTTPLAU
SCHEMBL4556569 0.83 PTGES (0.47) HCRTR1PTGESMEN1KMT2AHSP90AA1
SCHEMBL4555518 0.77 CA12 (0.45) CA12CA9HCRTR1HTTMEN1
SCHEMBL4556438 0.77 KMT2A (0.60) HTTPLAUMEN1KMT2ASMN1; SMN2
SCHEMBL6073367 0.77 CA12 (0.72) CA12CA9HTTMEN1KMT2A
SCHEMBL1664524 0.77 CA12 (0.56) CA12CA9HTTPLAUMEN1
SCHEMBL8752463 0.74 CA12 (1.00) CA12CA9HTTMEN1KMT2A
SCHEMBL3046360 0.72 CA12 (0.78) CA12CA9HTTMEN1KMT2A
SCHEMBL28930344 0.71 IL1RN (0.64) CA12CA9HTTMEN1KMT2A
SCHEMBL1320719 0.71 ACLY (0.53) CA12CA9HTTMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541074-B2 Optical film and optical compensatory film, polarizing plate and liquid crystal display using same FUJIFILM CORPORATION (JP) 2009-06-02 — — US disclosed
US-20070190268-A1 Optical film and optical compensatory film, polarizing plate and liquid crystal display using same FUJI PHOTO FILM CO., LTD. (JP) 2007-08-16 — — US disclosed
Send feedback