SCHEMBL5616893

SCHEMBL5616893

[CH2]CCCCn1cccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
TBXAS1 P24557 1/20 0.32
NPC1 O15118 6/20 0.31
RAB9A P51151 6/20 0.31
HTT P42858 5/20 0.31
LMNA P02545 3/20 0.31
APOBEC3A P31941 2/20 0.31
APOBEC3G Q9HC16 2/20 0.31
ALDH1A1 P00352 1/20 0.31
PABPC1 P11940 1/20 0.31
GALR3 O60755 2/20 0.30
POLB P06746 2/20 0.30
ATM Q13315 2/20 0.30
MAPK1 P28482 2/20 0.30
NPSR1 Q6W5P4 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
KDM4E B2RXH2 1/20 0.30
HSP90AA1 P07900 1/20 0.30
MAPT P10636 1/20 0.30
RAD52 P43351 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
SCHEMBL7039410 0.97 TP53 (0.37) TP53TBXAS1NPC1RAB9AHTT
SCHEMBL6414746 0.97 TP53 (0.37) TP53TBXAS1NPC1RAB9AHTT
SCHEMBL27593365 0.97 TP53 (0.37) TP53TBXAS1NPC1RAB9AHTT
SCHEMBL8329170 0.97 TP53 (0.37) TP53TBXAS1NPC1RAB9AHTT
SCHEMBL269446 0.92
SCHEMBL20465806 0.85 TP53 (0.48) TP53TBXAS1NPC1RAB9AHTT
SCHEMBL27458343 0.82 TP53 (0.46) TP53TBXAS1NPC1RAB9AHTT
SCHEMBL72436 0.79
SCHEMBL691481 0.78 TP53 (0.48) TP53TBXAS1NPC1RAB9AHTT
SCHEMBL7529371 0.72 TP53 (0.39) TP53TBXAS1NPC1RAB9AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856164-A1 SUPPORTED OLEFIN POLYMERIZATION CATALYSTS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2007-11-21 EP disclosed
WO-2006094302-A1 SUPPORTED OLEFIN POLYMERIZATION CATALYSTS E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-09-08 WO disclosed
US-20060199727-A1 Supported olefin polymerization catalysts E. I. DU PONT DE NEMOURS AND COMPANY 2006-09-07 US disclosed
WO-2004069145-A2 ANTICANCER COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2004-08-19 WO disclosed
EP-0867431-B1 Process for the preparation of azide derivatives EISAI CO LTD (JP) 2002-06-05 EP disclosed
US-6284317-B1 PROVIDING SURFACE COMPRISING UNITS HAVING SILION-HYDROGEN BONDS; EXPOSING TO ORGANOMETALLIC REAGENT; FORMING A SILICON-CARBON BOND AT A TEMPERATURE OF LESS THAN ABOUT 25.DEGREE. C. AND FREE OF AN EXTERNAL ENERGY SOURCE MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2001-09-04 US disclosed
US-5986088-A Process for the preparation of azide derivatives EISAI CO., LTD. (JP) 1999-11-16 US disclosed
EP-0867431-A1 Process for the preparation of azide derivatives Eisai Chemical Co., Ltd. (JP) 1998-09-30 EP disclosed