SCHEMBL11540389

SCHEMBL11540389

O=C(NCC1CC2C=CC1C2)NS(=O)(=O)C=Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
TDP1 Q9NUW8 3/20 0.40
PKM P14618 2/20 0.40
GAA P10253 2/20 0.39
HSP90AA1 P07900 2/20 0.38
MAPK1 P28482 2/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 4/20 0.38
KMT2A Q03164 3/20 0.38
TSHR P16473 1/20 0.34

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
SCHEMBL11540386 1.00 KDM4E (0.40) KDM4ETDP1PKMGAAHSP90AA1
SCHEMBL11540509 0.89 CNR1 (0.35) KDM4ETDP1PKMGAAMAPK1
SCHEMBL11540515 0.89 CNR1 (0.35) KDM4ETDP1PKMGAAMAPK1
SCHEMBL11538148 0.88 CA1 (0.36) ALDH1A1
SCHEMBL11538151 0.88 CA1 (0.36) ALDH1A1
SCHEMBL11539944 0.86 ALDH1A1 (0.42) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL11539948 0.86 ALDH1A1 (0.42) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL11538501 0.82 KDM4E (0.40) KDM4ETDP1PKMMAPK1ALDH1A1
SCHEMBL11537232 0.81 KDM4E (0.39) KDM4ETDP1PKMMAPK1ALDH1A1
SCHEMBL11537228 0.81 KDM4E (0.39) KDM4ETDP1PKMMAPK1ALDH1A1

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
US-4136180-A HYPOLIPIDEMIC SUBSTITUTED STYRENESULFONYLUREAS PFIZER INC. (US) 1979-01-23 US disclosed
US-4062960-A Hypolipidemic alkenesulfonamides PFIZER INC. (US) 1977-12-13 US disclosed
US-3983107-A ARTERIOSCLEROSIS PFIZER INC. (US) 1976-09-28 US disclosed