SCHEMBL9150347

SCHEMBL9150347

CCOC(=O)CCc1c(OCCCCC=Cc2ccc(OC)cc2)ccc2c(=O)c3cc(C(=O)OC)ccc3oc12

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 13/20 0.76
LTB4R2 Q9NPC1 8/20 0.46
DRD3 P35462 1/20 0.45
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 2/20 0.36
MET P08581 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL9149226 0.88 LTB4R (0.58) LTB4RLTB4R2TSHRKDM4EALDH1A1
SCHEMBL30410852 0.87 LTB4R (1.00) LTB4RLTB4R2DRD3KDM4EALDH1A1
SCHEMBL9148299 0.87 LTB4R (1.00) LTB4RLTB4R2DRD3KDM4EALDH1A1
SCHEMBL9148303 0.87 LTB4R (1.00) LTB4RLTB4R2DRD3KDM4EALDH1A1
SCHEMBL9150895 0.81 LTB4R (0.73) LTB4RLTB4R2TSHRKDM4EALDH1A1
SCHEMBL9154604 0.81 LTB4R (0.53) LTB4RLTB4R2DRD3TSHRKDM4E
SCHEMBL9154611 0.81 LTB4R (0.53) LTB4RLTB4R2DRD3TSHRKDM4E
SCHEMBL9150788 0.77 LTB4R (0.47) LTB4RLTB4R2TSHRKDM4EALDH1A1
SCHEMBL9150723 0.73 LTB4R (0.76) LTB4RLTB4R2DRD3KDM4EALDH1A1
SCHEMBL7449678 0.72 LTB4R (0.48) LTB4RLTB4R2TSHRKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442748-B1 Improvements in and relating to leukotriene antagonists LILLY CO ELI (US) 1995-01-11 EP disclosed
EP-0442748-A1 Improvements in and relating to leukotriene antagonists ELI LILLY AND COMPANY (US) 1991-08-21 EP disclosed
US-4996230-A Antiallergens, antiinflammatory agent ELI LILLY AND COMPANY (US) 1991-02-26 US disclosed