SCHEMBL8565876

SCHEMBL8565876

CCCC(=O)c1cc(-c2ccc(F)cc2)c(OC)cc1OCCCCl

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 9/20 0.43
LTB4R2 Q9NPC1 9/20 0.43
FFAR4 Q5NUL3 1/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
BCL9 O00512 1/20 0.37
CTNNB1 P35222 1/20 0.37

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
SCHEMBL8562239 0.86 SMN1; SMN2 (0.45) LTB4RLTB4R2FFAR4NPC1RAB9A
SCHEMBL8561282 0.81 HMGCR (0.52) LTB4RLTB4R2NPC1RAB9ASMN1; SMN2
SCHEMBL8567880 0.77 LTB4R (0.46) LTB4RLTB4R2
SCHEMBL8565315 0.76 L3MBTL1 (0.41) LTB4RLTB4R2NPC1RAB9ASMN1; SMN2
SCHEMBL15126033 0.75 LTB4R (0.49) LTB4RLTB4R2
SCHEMBL18909755 0.72 HMGCR (0.45) FFAR4NPC1RAB9ASMN1; SMN2CTNNB1
SCHEMBL8562241 0.72 SYK (0.44) FFAR4BCL9CTNNB1
SCHEMBL20795540 0.72 HDAC8 (0.45) FFAR4NPC1RAB9ASMN1; SMN2
SCHEMBL8560925 0.71 LTB4R (0.51) LTB4RLTB4R2
SCHEMBL8567276 0.71 SLC6A4 (0.45) FFAR4NPC1RAB9ASMN1; SMN2

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
EP-0544488-B1 Substituted phenyl phenol leukotriene antagonists LILLY CO ELI (US) 1998-03-11 EP disclosed
WO-1996036347-A1 USE OF LEUKOTRIENE ANTAGONISTS FOR ALZHEIMER'S DISEASE ELI LILLY AND COMPANY (US) 1996-11-21 WO disclosed
EP-0743064-A1 Leukotriene antagonists for use in the treatment or prevention of alzheimer's disease ELI LILLY AND COMPANY (US) 1996-11-20 EP disclosed
US-5462954-A Antiinflammatory, antiallergens; treating asthma ELI LILLY AND COMPANY (US) 1995-10-31 US disclosed
EP-0544488-A2 Substituted phenyl phenol leukotriene antagonists ELI LILLY AND COMPANY (US) 1993-06-02 EP disclosed