SCHEMBL9330453

SCHEMBL9330453

CCN(CC)CC.CNc1cc(=O)n(-c2ccc(S(=O)(=O)O)cc2)[nH]1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALKBH5 Q6P6C2 6/20 0.40
▸ MAPT P10636 4/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ GAA P10253 3/20 0.39
▸ HTT P42858 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ CYP2C19 P33261 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ LMNA P02545 3/20 0.32
▸ RECQL P46063 1/20 0.32
▸ MPL P40238 1/20 0.32
▸ CA2 P00918 2/20 0.32
▸ PTPN1 P18031 1/20 0.31
▸ PTPN6 P29350 1/20 0.31
▸ PTPN11 Q06124 1/20 0.31

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
SCHEMBL11494550 0.88 CYP2C19 (0.38) ALKBH5MAPTKMT2AALDH1A1GAA
SCHEMBL11489800 0.88 ALKBH5 (0.39) ALKBH5MAPTKMT2AALDH1A1GAA
SCHEMBL9330526 0.85 CYP2C19 (0.40) ALKBH5MAPTKMT2AALDH1A1GAA
SCHEMBL11489782 0.82 CYP2C19 (0.41) ALKBH5MAPTKMT2AALDH1A1GAA
SCHEMBL11494744 0.82 CYP2C19 (0.40) ALKBH5MAPTKMT2AALDH1A1GAA
SCHEMBL11493187 0.81 CYP2C9 (0.38) MAPTALDH1A1HTTTDP1TSHR
SCHEMBL11638385 0.80 CYP2C19 (0.38) ALKBH5MAPTKMT2AALDH1A1GAA
SCHEMBL11496671 0.77 ALKBH5 (0.40) ALKBH5MAPTKMT2AALDH1A1GAA
SCHEMBL11489795 0.77 ALKBH5 (0.37) ALKBH5MAPTKMT2AALDH1A1GAA
SCHEMBL11496040 0.76 KDM4E (0.43) MAPTALDH1A1GAAKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0295698-B1 Silver halide photographic light-sensitive materials FUJI PHOTO FILM CO LTD (JP) 1994-03-23 — — EP disclosed
US-4920031-A OXONOL DYES FUJI PHOTO FILM CO., LTD. (JP) 1990-04-24 — — US disclosed
EP-0295698-A2 Silver halide photographic light-sensitive materials FUJI PHOTO FILM CO., LTD. (JP) 1988-12-21 — — EP disclosed
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