Phosphine

Phosphine

SCHEMBL28030392

COC(=O)CC(=O)c1c(C)cc(C)cc1C.P

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ GAA P10253 2/20 0.40
▸ NLRP3 Q96P20 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ LMNA P02545 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ TAS1R3 Q7RTX0 2/20 0.38

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
SCHEMBL11053483 0.83 MEN1 (0.51) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL25938380 0.79 MEN1 (0.37) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL4320007 0.78 ALDH1A1 (0.45) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL13886370 0.76 MEN1 (0.49) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL11502422 0.76 GAA (0.43) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL28184684 0.75 NLRP3 (0.46) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL12581660 0.74 KMT2A (0.49) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL6908084 0.73 MEN1 (0.44) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL6905835 0.73 ALDH1A1 (0.41) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL1698306 0.73 L3MBTL1 (0.44) ALDH1A1MAPTMAPK1MEN1KMT2A

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-103168027-B Process for preparing cyclopropyl amide derivatives and intermediates related thereto ASTRAZENECA AB (SE) 2015-08-26 — — CN disclosed
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