SCHEMBL21028332

SCHEMBL21028332

CSc1ccc(Cc2c3n(c4ncccc24)CC(C(=O)O)CC3)c(C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 19/20 0.43
ELANE P08246 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
SCHEMBL21027855 0.86 PTGDR2 (0.54) PTGDR2
SCHEMBL21028035 0.82 PTGDR2 (0.48) PTGDR2
SCHEMBL21027877 0.78 PTGDR2 (0.45) PTGDR2
SCHEMBL21027863 0.75 PTGDR2 (0.52) PTGDR2
SCHEMBL21028012 0.72 PTGDR2 (0.51) PTGDR2
SCHEMBL21027977 0.72 PTGDR2 (0.51) PTGDR2
SCHEMBL21027843 0.72 PTGDR2 (0.51) PTGDR2
SCHEMBL21027856 0.71 PTGDR2 (0.47) PTGDR2
SCHEMBL21028326 0.68 PTGDR2 (0.41) PTGDR2
SCHEMBL22227397 0.65 PTGDR2 (0.73) PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3489235-A1 TRICYCLIC COMPOUND AS CRTH2 INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2019-05-29 EP disclosed