SCHEMBL8047378

SCHEMBL8047378

C=CCOc1ccc2nc(-c3ccc(/C=C/CCCC(C)OCCCCC)cc3)ccc2c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.37
SRC P12931 2/20 0.35
ABL1 P00519 1/20 0.35
MAOB P27338 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
THRB P10828 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CASR P41180 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
SCHEMBL8047383 1.00 MAPT (0.37) MAPTSRCABL1MAOBKDM4E
SCHEMBL8053830 0.96 MAPT (0.35) MAPTSRCABL1MAOBKDM4E
SCHEMBL8053826 0.96 MAPT (0.35) MAPTSRCABL1MAOBKDM4E
SCHEMBL8036690 0.90 KDM4E (0.40) MAPTSRCABL1KDM4ENPC1
SCHEMBL8036695 0.90 KDM4E (0.40) MAPTSRCABL1KDM4ENPC1
SCHEMBL8051701 0.89 MAPT (0.36) MAPTSRCABL1MAOBCASR
SCHEMBL8051699 0.89 MAPT (0.36) MAPTSRCABL1MAOBCASR
SCHEMBL8048991 0.89 NPC1 (0.36) SRCABL1KDM4ENPC1RAB9A
SCHEMBL8048978 0.89 NPC1 (0.36) SRCABL1KDM4ENPC1RAB9A
SCHEMBL8037755 0.89 SRC (0.38) SRCABL1CASR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0643119-B1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL CO (JP) 2000-04-26 EP disclosed
US-6030546-A FERROELECTRIC PHASE; LOW VISCOSITY;, THERMOSENSITIVITY OVER A BROAD AND EXHIBITS A LARGE TILT ANGLE AND A HIGH-SPEED RESPONSE PROPERTY;CHEMICAL INTERMEDIATES FOR PESTICIDES, DRUGS AND LIQUID CRYSTALS; BORIDING AND HYDROLYSIS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-29 US disclosed
US-5707547-A CONTAINING FLUORINATED BENZENE OR NAPHTHALENE RINGS AND/OR NITROGEN CONTAINING HETEROCYCLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-01-13 US disclosed
EP-0643119-A1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-15 EP disclosed