SCHEMBL7317547

SCHEMBL7317547

COC(=O)c1cccc(OC(C)C)c1NS(=O)(=O)c1ccc(OC)cc1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 3/20 0.41
MTNR1A P48039 2/20 0.41
MTNR1B P49286 2/20 0.41
GAA P10253 2/20 0.41
PKM P14618 1/20 0.41
HSP90AA1 P07900 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MCL1 Q07820 1/20 0.38
CNR1 P21554 1/20 0.38
LIMK2 P53671 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL7315552 0.94 MEN1 (0.48) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7323187 0.88 MTNR1A (0.48) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7324219 0.86 MEN1 (0.42) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7321962 0.85 HSP90AA1 (0.47) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7317223 0.85 GAA (0.41) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7315938 0.85 MEN1 (0.41) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7319110 0.85 HSP90AA1 (0.46) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7317804 0.84 KMT2A (0.54) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7323299 0.84 MEN1 (0.45) MEN1KMT2AALDH1A1MTNR1AMTNR1B
SCHEMBL7321080 0.84 MAPT (0.45) MEN1KMT2AMTNR1AMTNR1BGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed