SCHEMBL11208466

SCHEMBL11208466

CCP(CC)c1ccccc1.Cl[Au]

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.36
ESR1 P03372 4/20 0.33
ESR2 Q92731 4/20 0.33
KCNN4 O15554 1/20 0.33
PSIP1 O75475 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL231466 0.92 CYP3A4 (0.45) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL5588513 0.90 CYP3A4 (0.43) CYP3A4TDP1TP53ESR1ESR2
Phosphine SCHEMBL28045431 0.90 CYP3A4 (0.43) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL4257325 0.90 CYP3A4 (0.43) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL29598351 0.90 CYP3A4 (0.43) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL11551492 0.90 CYP3A4 (0.43) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL11530312 0.90 CYP3A4 (0.43) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL11729004 0.88 CYP3A4 (0.38) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL1984766 0.88 CYP3A4 (0.38) CYP3A4TDP1TP53ESR1ESR2
SCHEMBL7784620 0.88 CYP3A4 (0.38) CYP3A4TDP1TP53ESR1ESR2

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
EP-0003897-B1 PHOSPHINEGOLD(I)SALTS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM SMITHKLINE BECKMAN CORPORATION (US) 1983-05-25 EP disclosed
EP-0003897-A1 Phosphinegold(I)salts, process for their preparation and compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1979-09-05 EP disclosed
US-4096250-A ANTI-ARTHRITIC SMITHKLINE CORPORATION (US) 1978-06-20 US disclosed
US-3947565-A Anti-arthritic compositions comprising s-heterocyclic derivatives of phosphine or phosphite gold mercaptides and methods of producing anti-arthritic activity SMITHKLINE CORPORATION (US) 1976-03-30 US disclosed