SCHEMBL20198295

SCHEMBL20198295

Cc1ccc(P(=O)(c2ccccc2)c2ccc(P(=O)(c3ccccc3)c3ccc(I)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.50
LMNA P02545 5/20 0.47
MEN1 O00255 6/20 0.45
KMT2A Q03164 6/20 0.45
MAPT P10636 4/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 2/20 0.44
TSHR P16473 2/20 0.43
GAA P10253 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
ALDH1A1 P00352 2/20 0.40
ESR1 P03372 1/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
ALOX12 P18054 1/20 0.39
ACHE P22303 1/20 0.39

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
SCHEMBL20198328 0.96 HPGD (0.47) HPGDLMNAMEN1KMT2AMAPT
SCHEMBL12792085 0.89 LMNA (0.50) LMNAMEN1KMT2AMAPTTSHR
SCHEMBL17928368 0.89 HPGD (0.61) HPGDLMNAMEN1KMT2AMAPT
SCHEMBL4402281 0.89 HPGD (0.61) HPGDLMNAMEN1KMT2AMAPT
SCHEMBL4403188 0.89 HPGD (0.61) HPGDLMNAMEN1KMT2AMAPT
SCHEMBL83200 0.89 HPGD (0.61) HPGDLMNAMEN1KMT2AMAPT
SCHEMBL4402340 0.85 HPGD (0.56) HPGDLMNAMEN1KMT2AMAPT
Triphenylphosphine Oxide SCHEMBL29014409 0.83 LMNA (0.58) HPGDLMNAMEN1KMT2AMAPT
SCHEMBL23279569 0.80 ALDH1A1 (0.52) HPGDLMNAMEN1KMT2AMAPT
SCHEMBL28397519 0.80 ESR1 (0.64) HPGDLMNAMEN1KMT2AMAPT

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-1675930-B1 NEW MATERIALS FOR ELECTROLUMINESCENCE AND THE UTILIZATION THEREOF MERCK PATENT GMBH (DE) 2018-05-30 EP disclosed