SCHEMBL8711734

SCHEMBL8711734

C1=C(c2ccc(Oc3ccccc3)cc2)CCC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.46
TSHR P16473 1/20 0.46
KCNH2 Q12809 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
GSTP1 P09211 1/20 0.44
NPC1 O15118 3/20 0.44
ACMSD Q8TDX5 1/20 0.42
NR1H2 P55055 1/20 0.42
BAX Q07812 1/20 0.42
MAOA P21397 1/20 0.42
NISCH Q9Y2I1 1/20 0.41
GALR1 P47211 1/20 0.41
RAB9A P51151 2/20 0.40
SCN4A P35499 1/20 0.40
TLR8 Q9NR97 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 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
SCHEMBL22382753 0.86 KCNH2 (0.45) KCNH2HRH3NPC1ACMSDRAB9A
SCHEMBL6344544 0.81 ACMSD (0.49) KCNH2HRH3ACMSD
SCHEMBL360448 0.81 ACMSD (0.47) KCNH2HRH3ACMSD
SCHEMBL5280269 0.79 HRH3 (0.55) LTA4HKCNH2HRH3ACMSDMAOA
SCHEMBL5280276 0.76 PTGS2 (0.40) LTA4HKCNH2HRH3NPC1ACMSD
SCHEMBL8939884 0.76 KCNH2 (0.47) KCNH2HRH3NPC1ACMSDRAB9A
SCHEMBL6345485 0.75 ACMSD (0.50) ACMSD
SCHEMBL29140058 0.75 ADRA2A (0.53) LTA4HTSHRGSTP1NPC1NR1H2
SCHEMBL191429 0.74 ACMSD (0.49) ACMSD
SCHEMBL8380044 0.74 ACMSD (0.49) ACMSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1077568-C Phenoxyphenyl cyclopentenyl hydroxyureas PFIZER (US) 2002-01-09 CN disclosed
CN-1077568-C Phenoxyphenyl cyclopentenyl hydroxyureas PFIZER (US) 2002-01-09 CN disclosed
US-5792882-A Phenoxyphenyl cyclopentenyl hydroxyureas PFIZER INC. (US) 1998-08-11 US disclosed
CN-1129440-A Phenoxyphenyl cyclopentenyl hydroxyureas PFIZER (JP) 1996-08-21 CN disclosed
CN-1129440-A Phenoxyphenyl cyclopentenyl hydroxyureas PFIZER (JP) 1996-08-21 CN disclosed