SCHEMBL10280962

SCHEMBL10280962

C=Cc1cc(C(C)C)cc(C(C)C)c1-c1ccccc1P(=O)(OCC)OCC

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
POLB P06746 2/20 0.33
RXRA P19793 3/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
RARA P10276 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 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
SCHEMBL366679 0.88 MEN1 (0.41) MEN1KMT2APOLBRXRARXRB
SCHEMBL28154606 0.73 PTPN5 (0.36)
SCHEMBL29207398 0.72 MEN1 (0.49) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL20862831 0.72 FABP3 (0.33)
SCHEMBL365347 0.69 L3MBTL1 (0.36) POLB
SCHEMBL25183137 0.69 PTPN5 (0.39) POLB
SCHEMBL10280889 0.68 MEN1 (0.39) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL364797 0.67 MEN1 (0.45) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL10177339 0.67 L3MBTL1 (0.34) POLB
SCHEMBL28005451 0.67 NPSR1 (0.44) MEN1KMT2APOLBALDH1A1LMNA

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
WO-2012009698-A1 PHOSPHINE LIGANDS FOR CATALYTIC REACTIONS ABBOTT LABORATORIES (US) 2012-01-19 WO disclosed