SCHEMBL6156002

SCHEMBL6156002

c1ccc(P(C(=C(P(c2ccccc2)c2ccccc2)P(c2ccccc2)c2ccccc2)P(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.50
CYP3A4 P08684 2/20 0.50
ESR1 P03372 4/20 0.43
ESR2 Q92731 4/20 0.43
CA4 P22748 3/20 0.37
CA14 Q9ULX7 3/20 0.37
CA12 O43570 2/20 0.37
CA2 P00918 2/20 0.37
CA3 P07451 2/20 0.37
CA1 P00915 1/20 0.37
GLA P06280 1/20 0.37
CA9 Q16790 1/20 0.37
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 2/20 0.32
ALOX15 P16050 2/20 0.32
CA5A P35218 2/20 0.32
CA5B Q9Y2D0 2/20 0.32
NPC1 O15118 2/20 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
SCHEMBL10455271 0.81 TDP1 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL29980026 0.75 TDP1 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL7113981 0.75 TDP1 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL8719331 0.75 CYP3A4 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL4821057 0.75 CYP3A4 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL1518031 0.75 TDP1 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL7532752 0.75 CYP3A4 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL8721614 0.75 TDP1 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL4973930 0.75 TDP1 (0.45) TDP1CYP3A4ESR1ESR2CA4
SCHEMBL3155593 0.75 CYP3A4 (0.45) TDP1CYP3A4ESR1ESR2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1525631-A2 REDUCTION OF THE CONTACT RESISTANCE IN ORGANIC FIELD EFFECT TRANSISTORS COMPRISING PALLADIUM CONTACTS BY THE USE OF PHOSPHINES AND PHOSPHINES CONTAINING METAL Infineon Technologies AG (DE) 2005-04-27 EP disclosed
WO-2004017440-A2 REDUCTION OF THE CONTACT RESISTANCE IN ORGANIC FIELD EFFECT TRANSISTORS COMPRISING PALLADIUM CONTACTS BY THE USE OF PHOSPHINES AND PHOSPHINES CONTAINING METAL INFINEON TECHNOLOGIES AG (DE) 2004-02-26 WO disclosed