SCHEMBL11201805

SCHEMBL11201805

COC(=O)CC(=O)c1ccc(S(=O)(=O)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ CA2 P00918 4/20 0.40
▸ CA12 O43570 3/20 0.40
▸ CA1 P00915 3/20 0.40
▸ CA9 Q16790 3/20 0.40
▸ CA14 Q9ULX7 1/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ ALOX15 P16050 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ MAPT P10636 1/20 0.38

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
SCHEMBL10541229 0.84 GSR (0.54) KMT2AMEN1GSR
SCHEMBL17291035 0.80 L3MBTL1 (0.53) KMT2AMEN1KDM4ENPC1RAB9A
SCHEMBL17290764 0.80 ALDH1A1 (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1GAA
SCHEMBL12049935 0.78 SMN1; SMN2 (0.50) KMT2ARAB9ASMN1; SMN2CA2CA12
SCHEMBL25771440 0.78 CA1 (0.61) RAB9ASMN1; SMN2ALDH1A1GAAHPGD
SCHEMBL452462 0.78 PLOD2 (0.56) KMT2AMEN1KDM4ENPC1RAB9A
SCHEMBL17290525 0.78 MEN1 (0.41) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL2908590 0.77 PLOD2 (0.55) KMT2AMEN1KDM4ENPC1RAB9A
SCHEMBL21456549 0.76 SMN1; SMN2 (0.52) KMT2AMEN1KDM4ENPC1RAB9A
SCHEMBL333688 0.76 CA1 (0.57) KMT2AMEN1NPC1RAB9ASMN1; 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-0015602-B1 NOVEL LIGHT-ABSORBING METHINE DYES AND PHOTOGRAPHIC MATERIALS CONTAINING THEM AGFA-GEVAERT N.V. (BE) 1983-09-21 — — EP disclosed
US-4266014-A Photographic materials containing light absorbing methine dyes AGFA-GEVAERT N.V. (BE) 1981-05-05 — — US disclosed
EP-0015602-A1 Novel light-absorbing methine dyes and photographic materials containing them AGFA-GEVAERT N.V. (BE) 1980-09-17 — — EP disclosed
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