SCHEMBL7283241

SCHEMBL7283241

CC(C(=O)O)C1=CCC(=C=O)C=C1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.30

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
SCHEMBL28723323 0.79 AKR1C3 (0.31)
SCHEMBL18283317 0.72
SCHEMBL10464808 0.65
SCHEMBL28847470 0.64 PTGS2 (0.33) PTGS2
SCHEMBL466694 0.64
Hydrochloric Acid SCHEMBL29968926 0.63 PTGS2 (0.33) PTGS2
SCHEMBL14972831 0.62
SCHEMBL13079398 0.56 LMNA (0.42) PTGS2
SCHEMBL6154308 0.56
SCHEMBL2204495 0.55 PTGS2 (0.56) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106316837-B Preparation method of substituted phenylacetic acid derivative 浙江九洲药业股份有限公司 2020-04-24 CN claimed
CN-106316837-B Preparation method of substituted phenylacetic acid derivative 浙江九洲药业股份有限公司 2020-04-24 CN disclosed
EP-0330241-A2 Calcitonin derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-08-30 EP disclosed