SCHEMBL7354897

SCHEMBL7354897

C=Cc1cc(C)c(NS(=O)(=O)c2ccc(OC)cc2Cc2ccccc2)c(C(=O)OC)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
MCL1 Q07820 1/20 0.39
HSP90AA1 P07900 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 4/20 0.38
PKM P14618 1/20 0.38
PLA2G2A P14555 2/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 1/20 0.37
HTR2C P28335 1/20 0.36
CYTH2 Q99418 1/20 0.36

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
SCHEMBL7325389 0.94 METAP2 (0.43) FFAR4MTNR1AMTNR1BMCL1ALDH1A1
SCHEMBL7321197 0.93 MTNR1A (0.41) FFAR4MTNR1AMTNR1BHSP90AA1ALDH1A1
SCHEMBL7317403 0.88 METAP2 (0.48) FFAR4MTNR1AMTNR1BHSP90AA1ALDH1A1
SCHEMBL7318301 0.87 MTNR1A (0.43) FFAR4MTNR1AMTNR1BHSP90AA1ALDH1A1
SCHEMBL7313794 0.86 MTNR1A (0.42) MTNR1AMTNR1BHSP90AA1ALDH1A1GAA
SCHEMBL7316525 0.86 ALDH1A1 (0.42) MTNR1AMTNR1BHSP90AA1ALDH1A1GAA
SCHEMBL7315541 0.84 MTNR1A (0.40) MTNR1AMTNR1BHSP90AA1ALDH1A1GAA
SCHEMBL7322288 0.83 MMP1 (0.50) MTNR1AMTNR1BHSP90AA1ALDH1A1GAA
SCHEMBL7322650 0.81 METAP2 (0.58) FFAR4MTNR1AMTNR1BMCL1ALDH1A1
SCHEMBL7313454 0.81 ACLY (0.51) FFAR4MTNR1AMTNR1BMCL1ALDH1A1

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