SCHEMBL2489037

SCHEMBL2489037

C=CCN(O)S(=O)(=O)CC=C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL6528896 0.75 KDM4E (0.36) ALDH1A1MEN1KMT2A
SCHEMBL3123404 0.73
SCHEMBL8025791 0.73
Hydrochloric Acid SCHEMBL11283346 0.71
SCHEMBL14889352 0.70
SCHEMBL7239582 0.70
SCHEMBL27309827 0.69 GRIN2D (0.33)
SCHEMBL27783120 0.69 RAB9A (0.44) ALDH1A1MEN1KMT2A
SCHEMBL10373794 0.68
SCHEMBL9766287 0.68 ALDH1A1 (0.31) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3979454-A Process for the production of alkyl sulphonic acid hydroxy alkyl amides BAYER AKTIENGESELLSCHAFT (DT) 1976-09-07 US claimed
EP-2367813-A1 ANTIVIRAL COMPOUNDS Gilead Sciences, Inc. (US) 2011-09-28 EP disclosed
WO-2010075127-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2010-07-01 WO disclosed
US-3979454-A Process for the production of alkyl sulphonic acid hydroxy alkyl amides BAYER AKTIENGESELLSCHAFT (DT) 1976-09-07 US disclosed
US-3979454-A Process for the production of alkyl sulphonic acid hydroxy alkyl amides BAYER AKTIENGESELLSCHAFT (DT) 1976-09-07 US disclosed
US-3979454-A Process for the production of alkyl sulphonic acid hydroxy alkyl amides BAYER AKTIENGESELLSCHAFT (DT) 1976-09-07 US disclosed