SCHEMBL7465159

SCHEMBL7465159

Fc1cnc(CCCCCc2ccccc2)nc1F

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.44
MAOA P21397 1/20 0.43
FAAH O00519 4/20 0.42
SIGMAR1 Q99720 6/20 0.41
CES1 P23141 1/20 0.40
NAAA Q02083 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL8332511 0.71 HPGD (0.53) MAOASIGMAR1NAAAMAPTRXFP1
SCHEMBL27372800 0.70 HTR2C (0.49) HTR2C
SCHEMBL1226782 0.70 SIGMAR1 (0.71) MAOASIGMAR1MAPTRXFP1
SCHEMBL6546948 0.70 SIGMAR1 (0.71) MAOASIGMAR1MAPTRXFP1
SCHEMBL8096690 0.70 SIGMAR1 (0.71) MAOASIGMAR1MAPTRXFP1
SCHEMBL2823250 0.70 SIGMAR1 (0.71) MAOASIGMAR1MAPTRXFP1
SCHEMBL8095284 0.70 SIGMAR1 (0.71) MAOASIGMAR1MAPTRXFP1
SCHEMBL676854 0.70 SIGMAR1 (0.71) MAOASIGMAR1MAPTRXFP1
SCHEMBL1433686 0.70 SIGMAR1 (0.71) MAOASIGMAR1MAPTRXFP1
SCHEMBL8094527 0.70 SIGMAR1 (0.71) MAOASIGMAR1MAPTRXFP1

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-0817773-B1 PYRIMIDINE COMPOUNDS QINETIQ LTD (GB) 2002-06-12 EP disclosed
US-6121448-A LIQUID CRYSTALLINE COMPOUNDS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITTANIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 2000-09-19 US disclosed
US-5986096-A REACTION OF HYDROGEN IODIDE WITH CHLORO-5-BROMOPYRIMIDINE THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S A GOVERNMENT OF THE U.K. OF GT. BRITAIN & N. IRELAND OF DEFENCE EVALUATION & RESEARCH AGENCY (GB) 1999-11-16 US disclosed
WO-1996030344-A2 PYRIMIDINE COMPOUNDS THE SECRETARY OF STATE FOR DEFENCE (GB) 1996-10-03 WO disclosed