SCHEMBL1904565

SCHEMBL1904565

CCC(C(=O)O)n1c2c(c3cc(F)ccc31)CC(N(C)C(=O)NCc1ccccc1)CC2

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 19/20 0.49
HTR6 P50406 1/20 0.47

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
SCHEMBL1904560 1.00 PTGDR2 (0.49) PTGDR2HTR6
SCHEMBL1905370 0.92 PTGDR2 (0.48) PTGDR2HTR6
SCHEMBL1905371 0.92 PTGDR2 (0.48) PTGDR2HTR6
SCHEMBL1904859 0.90 PTGDR2 (0.46) PTGDR2HTR6
SCHEMBL1904862 0.90 PTGDR2 (0.46) PTGDR2HTR6
SCHEMBL1905850 0.90 PTGDR2 (0.44) PTGDR2HTR6
SCHEMBL1899970 0.88 PTGDR2 (0.46) PTGDR2HTR6
SCHEMBL1899967 0.88 PTGDR2 (0.46) PTGDR2HTR6
SCHEMBL1901585 0.88 PTGDR2 (0.43) PTGDR2HTR6
SCHEMBL1901587 0.88 PTGDR2 (0.43) PTGDR2HTR6

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