SCHEMBL21032209

SCHEMBL21032209

Cc1c(-c2csc3cc(C(F)(F)F)ccc23)c2cc(Cl)ccc2n1CC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.61
PTGS1 P23219 1/20 0.51

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
SCHEMBL21032151 0.93 PTGDR2 (0.62) PTGDR2PTGS1
SCHEMBL21032469 0.90 PTGDR2 (0.60) PTGDR2
SCHEMBL21032723 0.90 PTGDR2 (0.66) PTGDR2PTGS1
SCHEMBL21032474 0.89 PTGDR2 (0.61) PTGDR2PTGS1
SCHEMBL21031874 0.87 PTGDR2 (0.45) PTGDR2PTGS1
SCHEMBL21032143 0.87 PTGDR2 (0.61) PTGDR2PTGS1
SCHEMBL21032561 0.86 PTGDR2 (0.59) PTGDR2PTGS1
SCHEMBL21032471 0.85 PTGDR2 (0.57) PTGDR2PTGS1
SCHEMBL317472 0.84 PTGDR2 (0.57) PTGDR2PTGS1
SCHEMBL21032459 0.83 PTGDR2 (0.57) PTGDR2PTGS1

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-3489233-B1 INDOLE DERIVATIVE USED AS CRTH2 INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) 2022-01-12 EP disclosed
EP-3489233-A1 INDOLE DERIVATIVE USED AS CRTH2 INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2019-05-29 EP disclosed