SCHEMBL8051345

SCHEMBL8051345

C=CCOc1ccc2nc(-c3ccc(C=CCCCC(C)O)c(F)c3)cnc2c1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
APP P05067 9/20 0.38
MAOB P27338 2/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
P2RY12 Q9H244 1/20 0.35
MAPT P10636 6/20 0.35
SRC P12931 2/20 0.34
ABL1 P00519 1/20 0.34

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
SCHEMBL8051338 1.00 APP (0.38) APPMAOBPDE3BPDE3AP2RY12
SCHEMBL8049309 0.89 MAPT (0.43) MAOBPDE3BPDE3AP2RY12MAPT
SCHEMBL8049314 0.89 MAPT (0.43) MAOBPDE3BPDE3AP2RY12MAPT
SCHEMBL8048455 0.89 PDE3B (0.36) MAOBPDE3BPDE3AP2RY12MAPT
SCHEMBL8048458 0.89 PDE3B (0.36) MAOBPDE3BPDE3AP2RY12MAPT
SCHEMBL8047653 0.88 APP (0.40) APPMAOBPDE3BPDE3AP2RY12
SCHEMBL8047647 0.88 APP (0.40) APPMAOBPDE3BPDE3AP2RY12
SCHEMBL8051555 0.88 PDE3B (0.36) APPMAOBPDE3BPDE3AP2RY12
SCHEMBL8051551 0.88 PDE3B (0.36) APPMAOBPDE3BPDE3AP2RY12
SCHEMBL8036579 0.87 GPR119 (0.35) MAOBPDE3BPDE3AP2RY12MAPT

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