SCHEMBL8047374

SCHEMBL8047374

C=CCOc1ccc(-c2ccc3cc(/C=C/CCCC(C)O)ccc3c2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.32
FLT3 P36888 1/20 0.31
CHEK1 O14757 1/20 0.30
CDK4 P11802 1/20 0.30
CCNA2 P20248 1/20 0.30
CCND1 P24385 1/20 0.30
CDK2 P24941 1/20 0.30
CCND3 P30281 1/20 0.30
KDR P35968 1/20 0.30
ABL1 P00519 1/20 0.30
SRC P12931 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
SCHEMBL8047376 1.00 PDE4B (0.32) PDE4BFLT3CHEK1CDK4CCNA2
SCHEMBL8051683 0.90 FLT3 (0.31) FLT3
SCHEMBL8051678 0.90 FLT3 (0.31) FLT3
SCHEMBL8051206 0.89 FLT3 (0.31) FLT3
SCHEMBL8051210 0.89 FLT3 (0.31) FLT3
SCHEMBL8051742 0.88 CHEK1 (0.33) PDE4BFLT3CHEK1CDK4CCNA2
SCHEMBL8051744 0.88 CHEK1 (0.33) PDE4BFLT3CHEK1CDK4CCNA2
SCHEMBL8047994 0.88 NPC1 (0.31)
SCHEMBL8048000 0.88 NPC1 (0.31)
SCHEMBL8054645 0.87 SRC (0.36) ABL1SRC

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