SCHEMBL1901602

SCHEMBL1901602

CCc1ccc(CCC(=O)N[C@H]2CCc3c(c4cc(F)ccc4n3C(CC)C(=O)O)C2)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 17/20 0.49
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
TBXA2R P21731 2/20 0.36
PTGDR Q13258 2/20 0.36
ABCB11 O95342 1/20 0.36
CYP2C9 P11712 1/20 0.36
DRD1 P21728 1/20 0.36
CCKAR P32238 1/20 0.36

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
SCHEMBL1901604 1.00 PTGDR2 (0.49) PTGDR2MTNR1AMTNR1BTBXA2RPTGDR
SCHEMBL1900419 0.97 PTGDR2 (0.51) PTGDR2MTNR1AMTNR1BTBXA2RPTGDR
SCHEMBL2490234 0.97 PTGDR2 (0.51) PTGDR2MTNR1AMTNR1BTBXA2RPTGDR
SCHEMBL1905003 0.94 PTGDR2 (0.49) PTGDR2MTNR1AMTNR1BTBXA2RPTGDR
SCHEMBL1900305 0.94 PTGDR2 (0.49) PTGDR2MTNR1AMTNR1B
SCHEMBL1905005 0.94 PTGDR2 (0.49) PTGDR2MTNR1AMTNR1BTBXA2RPTGDR
SCHEMBL1900264 0.94 PTGDR2 (0.49) PTGDR2MTNR1AMTNR1B
SCHEMBL1900267 0.94 PTGDR2 (0.49) PTGDR2MTNR1AMTNR1B
SCHEMBL1902243 0.94 PTGDR2 (0.54) PTGDR2MTNR1AMTNR1BTBXA2RPTGDR
SCHEMBL1902244 0.94 PTGDR2 (0.54) PTGDR2MTNR1AMTNR1BTBXA2RPTGDR

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-2051962-B1 (3-AMINO-1,2,3,4-TETRAHYDRO-9H-CARBAZOL-9-YL)-ACETIC ACID DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2011-10-26 EP disclosed
EP-2316824-A1 (3-Amino-1,2,3,4-tetrahydro-9H-carbazoI-9-yl)-acetic acid derivates Actelion Pharmaceuticals Ltd. (CH) 2011-05-04 EP disclosed