Phosphine

Phosphine

SCHEMBL28294838

COc1ccc(C(=O)C(C(=O)c2ccc(OC)cc2OC)C(C)(C)CC(C)CP=O)c(OC)c1.NCc1cc[c]cc1.P

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
HIF1A Q16665 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
KLKB1 P03952 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
PARP15 Q460N3 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
HPGD P15428 1/20 0.32
RAD52 P43351 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
SCHEMBL338325 0.88 TP53 (0.45) TP53HIF1ASMN1; SMN2LMNAHTT
SCHEMBL4145899 0.74 CYP3A4 (0.38) SMN1; SMN2LMNAKMT2A
SCHEMBL14637516 0.71 SMN1; SMN2 (0.45) TP53SMN1; SMN2LMNAHTTMEN1
SCHEMBL15362 0.71 CA12 (0.40) SMN1; SMN2LMNAALDH1A1
SCHEMBL28239957 0.71 CA12 (0.40) SMN1; SMN2LMNAALDH1A1
SCHEMBL20544420 0.67 CA12 (0.36) SMN1; SMN2LMNAALDH1A1
SCHEMBL28041116 0.66 TP53 (0.48) TP53HIF1ASMN1; SMN2LMNAHTT
Benzoic Acid SCHEMBL28208456 0.65 MRGPRX4 (0.40) LMNAHTTMEN1KMT2ANPC1
SCHEMBL28255677 0.65 NPC1 (0.48) TP53HIF1ASMN1; SMN2LMNAHTT
SCHEMBL7179709 0.64 TDP1 (0.37) TP53MEN1KMT2AALDH1A1TDP1

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
CN-109689617-A Fluorene derivative, organic light emitting device using the same, and method of manufacturing the same 株式会社LG化学 2019-04-26 CN disclosed