SCHEMBL14423938

SCHEMBL14423938

CCBc1ccc(NS(=O)(=O)c2cccc(CC(C)CC)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PGR P06401 6/20 0.43
HTR6 P50406 2/20 0.43
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HDAC1 Q13547 1/20 0.40
RORC P51449 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
HDAC8 Q9BY41 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL14423923 0.75 AKR1C3 (0.58) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL1692226 0.73 HTR6 (0.63) PGRHTR6KMT2AMEN1ALDH1A1
SCHEMBL14423937 0.73 PTPN1 (0.44) PGRHTR6KMT2AMEN1ALDH1A1
SCHEMBL14423939 0.71 HDAC1 (0.44) PGRHTR6KMT2AMEN1ALDH1A1
SCHEMBL14198609 0.71 CA2 (0.50)
SCHEMBL1696862 0.69 HTR6 (0.68) PGRHTR6KMT2AMEN1ALDH1A1
SCHEMBL14423934 0.68 CA2 (0.40) PGRKMT2AMEN1ALDH1A1MAPT
SCHEMBL27387852 0.65 KMT2A (0.58) PGRHTR6KMT2AMEN1ALDH1A1
SCHEMBL18970321 0.64 TNNI3K (0.46) HTR6KMT2AALDH1A1LMNAKDM4E
SCHEMBL8429305 0.64 HDAC1 (0.65) PGRHTR6KMT2AMEN1ALDH1A1

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-7262318-B2 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER, INC. (US) 2007-08-28 US disclosed