SCHEMBL7533622

SCHEMBL7533622

NCCCc1cccc(OCOC2CCc3ccccc32)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.42
IDO1 P14902 2/20 0.42
HTR2A P28223 1/20 0.38
GFRA2 O00451 1/20 0.37
GFRA3 O60609 1/20 0.37
TAAR1 Q96RJ0 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
SCHEMBL7533620 0.79 IDO1 (0.46) GPR84IDO1HTR2ATAAR1
SCHEMBL7258599 0.72 IDO1 (0.63) GPR84IDO1HTR2A
SCHEMBL7533615 0.72 IDO1 (0.38) GPR84IDO1GFRA2GFRA3
SCHEMBL7425987 0.71 SMPD1 (0.47) IDO1
SCHEMBL2206248 0.71 TAAR1 (0.45) TAAR1
SCHEMBL1745124 0.70 GFRA3 (0.52) GFRA2GFRA3
SCHEMBL7410008 0.70 IDO1 (0.61) GPR84IDO1HTR2A
SCHEMBL2206195 0.69 CYP4F2 (0.66)
SCHEMBL2207165 0.69 MAOA (0.53) IDO1TAAR1
SCHEMBL20332570 0.69 KCNA3 (0.53) TAAR1

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
EP-0874819-A1 IMIDES AS PDE III, PDE IV AND TNF INHIBITORS CELGENE CORPORATION (US) 1998-11-04 EP disclosed
WO-1997023457-A1 IMIDES AS PDE III, PDE IV AND TNF INHIBITORS CELGENE CORPORATION (US) 1997-07-03 WO disclosed