SCHEMBL8418172

SCHEMBL8418172

COC(=O)CCCc1ccc(C(O)CCCC(F)(F)C(F)(F)F)s1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.46
PTGER2 P43116 1/20 0.39
RPS6KB2 Q9UBS0 1/20 0.35
MLYCD O95822 1/20 0.34
APP P05067 2/20 0.34
PPARG P37231 2/20 0.34
TRPV1 Q8NER1 1/20 0.34
PKM P14618 1/20 0.33
TSHR P16473 1/20 0.33
PPARA Q07869 1/20 0.32

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
SCHEMBL8417489 0.98 HPGD (0.44) HPGDPTGER2RPS6KB2MLYCDAPP
SCHEMBL8421719 0.96 HPGD (0.51) HPGDPTGER2RPS6KB2MLYCDAPP
SCHEMBL8419376 0.93 HPGD (0.44) HPGDPTGER2RPS6KB2MLYCDAPP
SCHEMBL8421783 0.92 HPGD (0.45) HPGDPTGER2RPS6KB2MLYCDAPP
SCHEMBL8418028 0.92 HPGD (0.47) HPGDPTGER2RPS6KB2MLYCDAPP
SCHEMBL8421209 0.91 HPGD (0.43) HPGDPTGER2RPS6KB2MLYCDAPP
SCHEMBL8421740 0.90 HPGD (0.42) HPGDPTGER2RPS6KB2MLYCDAPP
SCHEMBL8419344 0.89 HPGD (0.45) HPGDRPS6KB2MLYCDAPPTRPV1
SCHEMBL8419352 0.89 HPGD (0.45) HPGDPTGER2RPS6KB2MLYCDAPP
SCHEMBL8419571 0.89 HPGD (0.41) HPGDPTGER2RPS6KB2MLYCDAPP

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
EP-0943606-A1 BENZENESULFONAMIDE DERIVATIVES AND DRUGS CONTAINING THE SAME HOKURIKU SEIYAKU CO., LTD. (JP) 1999-09-22 EP disclosed