SCHEMBL8055037

SCHEMBL8055037

CC(C)P(Cc1ccc2ccccc2c1-c1c(CP(c2ccc(F)cc2)c2ccc(F)cc2)ccc2ccccc12)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
LMNA P02545 1/20 0.30
MAPT P10636 2/20 0.30
THRB P10828 1/20 0.30
MAPK1 P28482 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL8022208 0.90 CES1 (0.37) CES1L3MBTL1MEN1NPC1RAB9A
SCHEMBL8056374 0.89 MAPT (0.33) MAPTTDP1
SCHEMBL8056031 0.88 CES1 (0.36) CES1L3MBTL1MEN1NPC1RAB9A
SCHEMBL8043523 0.79 MAPT (0.30) MAPT
SCHEMBL8023619 0.79 MAPT (0.36) L3MBTL1MEN1NPC1RAB9AKMT2A
SCHEMBL8055034 0.78 KCNJ11 (0.32) SLC6A2SLC6A4
SCHEMBL29447338 0.78 ALDH1A1 (0.39) MAPTTDP1
SCHEMBL3955072 0.78 ALDH1A1 (0.39) MAPTTDP1
SCHEMBL8029660 0.77 CYP2A6 (0.42) MAPTTDP1
SCHEMBL6420832 0.77 CYP2A6 (0.36) CES1MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0704449-B1 Process for the preparation of diphosphanes CELANESE CHEM EUROPE GMBH (DE) 2000-05-24 EP disclosed
US-5696296-A Diphosphines and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1997-12-09 US disclosed
EP-0704449-A1 Diphosphanes and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1996-04-03 EP disclosed