SCHEMBL5497575

SCHEMBL5497575

CC1CC(NC(=O)Cc2ccccc2)c2ccccc2N1C(=O)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 7/20 0.74
LMNA P02545 3/20 0.58
SMN1; SMN2 Q16637 1/20 0.55
GFER P55789 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL5397091 0.85 PTGDR2 (1.00) PTGDR2LMNASMN1; SMN2MEN1KMT2A
SCHEMBL5404990 0.85 PTGDR2 (1.00) PTGDR2LMNASMN1; SMN2MEN1KMT2A
SCHEMBL5504734 0.85 PTGDR2 (0.58) PTGDR2LMNANPSR1MEN1KMT2A
SCHEMBL27641688 0.84 MAPT (0.55) PTGDR2LMNASMN1; SMN2GFERNPSR1
SCHEMBL5513344 0.84 PTGDR2 (0.56) PTGDR2LMNANPSR1MEN1KMT2A
SCHEMBL5444441 0.83 PTGDR2 (0.52) PTGDR2LMNASMN1; SMN2GFERNPSR1
SCHEMBL6281793 0.82 PTGDR2 (0.51) PTGDR2LMNASMN1; SMN2GFERNPSR1
SCHEMBL5440260 0.82 PTGDR2 (0.65) PTGDR2LMNASMN1; SMN2
SCHEMBL6276664 0.81 PTGDR2 (0.53) PTGDR2LMNASMN1; SMN2GFERNPSR1
SCHEMBL4130883 0.80 PTGDR2 (0.71) PTGDR2LMNASMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1556047-A2 PGD2 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-07-27 EP claimed
WO-2004032848-A2 PGD2 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES MILLENNIUM PHARMACEUTICALS, INC. (US) 2004-04-22 WO claimed
EP-1740547-A1 PGD2 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-01-10 EP disclosed
WO-2005100321-A1 PGD2 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-10-27 WO disclosed
EP-1556356-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CRTH2 ANTAGONISTS Warner-Lambert Company LLC (US) 2005-07-27 EP disclosed
WO-2004035543-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CRTH2 ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2004-04-29 WO disclosed