SCHEMBL1894403

SCHEMBL1894403

CCc1ccccc1N(C)C(=O)Cc1cc(C(=O)O)cc2c(OCc3ccccc3)cccc12

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 15/20 0.69
LTB4R2 Q9NPC1 14/20 0.69
MRGPRX4 Q96LA9 4/20 0.47
SRD5A2 P31213 1/20 0.43

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
SCHEMBL29396901 0.82 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL1894401 0.82 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9022467 0.79 LTB4R (0.80) LTB4RLTB4R2MRGPRX4
SCHEMBL7959149 0.75 LTB4R (0.60) LTB4RLTB4R2MRGPRX4SRD5A2
SCHEMBL9022847 0.75 LTB4R (0.84) LTB4RLTB4R2
SCHEMBL9023332 0.74 LTB4R (0.83) LTB4RLTB4R2
SCHEMBL3363178 0.71 LTB4R (0.68) LTB4RLTB4R2
SCHEMBL4315471 0.68 HTR1A (0.53) LTB4RLTB4R2
SCHEMBL28388546 0.67 LMNA (0.51) LTB4RLTB4R2MRGPRX4SRD5A2
SCHEMBL30091828 0.67 LMNA (0.51) LTB4RLTB4R2MRGPRX4SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110105959-A1 Novel Methods for Bone Treatment by Modulating an Arachidonic Acid Metabolic or Signaling Pathway ACCELALOX, INC. (US) 2011-05-05 US disclosed
WO-2009105723-A2 NOVEL METHODS FOR BONE TREATMENT BY MODULATING AN ARACHIDONIC ACID METABOLIC OR SIGNALING PATHWAY ACCELALOX, INC. (US) 2009-08-27 WO disclosed