SCHEMBL6465027

SCHEMBL6465027

CC(C)(Cl)CS(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.56
HSD11B1 P28845 5/20 0.52
ALDH1A1 P00352 5/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RECQL P46063 1/20 0.44
RAB9A P51151 1/20 0.44
HSD17B10 Q99714 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 1/20 0.43
HTT P42858 2/20 0.42
TP53 P04637 1/20 0.42
MMP1 P03956 2/20 0.41
MMP2 P08253 2/20 0.41
MMP13 P45452 2/20 0.41
HTR6 P50406 1/20 0.41
HPGD P15428 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL22218952 0.83 PSIP1 (0.54) PSIP1HSD11B1ALDH1A1HSD17B10TDP1
SCHEMBL2446368 0.83 PSIP1 (0.60) PSIP1HSD11B1ALDH1A1KMT2AMEN1
SCHEMBL7296389 0.81 PSIP1 (0.58) PSIP1HSD11B1ALDH1A1KMT2AMEN1
SCHEMBL7348328 0.79 HSD11B1 (0.56) PSIP1HSD11B1ALDH1A1KMT2AMEN1
SCHEMBL19248406 0.79 PSIP1 (0.56) PSIP1HSD11B1ALDH1A1KMT2AMEN1
SCHEMBL1540325 0.79 PSIP1 (0.56) PSIP1HSD11B1ALDH1A1KMT2AMEN1
SCHEMBL1540327 0.79 PSIP1 (0.56) PSIP1HSD11B1ALDH1A1KMT2AMEN1
SCHEMBL1527680 0.79 HSD11B1 (0.56) PSIP1HSD11B1ALDH1A1KMT2AMEN1
SCHEMBL2446758 0.78 PSIP1 (0.59) PSIP1HSD11B1ALDH1A1KMT2AMEN1
SCHEMBL11187026 0.76 PSIP1 (0.47) PSIP1HSD11B1ALDH1A1HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050042676-A1 Characterising polypeptides ELECTROPHORETICS LIMITED (GB) 2005-02-24 US disclosed
EP-1397505-A2 CHARACTERISING POLYPEPTIDES Xzillion GmbH & CO.KG (DE) 2004-03-17 EP disclosed
EP-1267170-A1 Method for characterising polypeptides Xzillion GmbH & CO.KG (DE) 2002-12-18 EP disclosed
WO-2002099124-A2 CHARACTERISING POLYPEPTIDES XZILLION GMBH & CO. KG (DE) 2002-12-12 WO disclosed