SCHEMBL28436522

SCHEMBL28436522

O=C[C@H]1CC(F)(F)C(=O)N1CCCCCCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 16/20 0.64
▸ PTGER2 P43116 8/20 0.64
▸ PTGER3 P43115 8/20 0.64
▸ KCNH2 Q12809 1/20 0.57
▸ PTGER1 P34995 1/20 0.39
▸ PTGS1 P23219 4/20 0.39
▸ PTGS2 P35354 4/20 0.39

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
SCHEMBL16058266 1.00 PTGER4 (0.64) PTGER4PTGER2PTGER3KCNH2PTGER1
SCHEMBL16819140 0.84 PTGER4 (0.51) PTGER4PTGER2PTGER3KCNH2
SCHEMBL15587107 0.84 PTGER4 (0.51) PTGER4PTGER2PTGER3KCNH2
SCHEMBL18942727 0.82 PTGER4 (0.56) PTGER4PTGER2PTGER3KCNH2PTGS1
SCHEMBL18943127 0.81 PTGER4 (0.73) PTGER4PTGER2PTGER3KCNH2PTGS1
SCHEMBL28427873 0.81 PTGER4 (0.52) PTGER4PTGER2PTGER3KCNH2PTGS1
SCHEMBL28427872 0.81 PTGER4 (0.52) PTGER4PTGER2PTGER3KCNH2PTGS1
SCHEMBL18123934 0.79 PTGER4 (1.00) PTGER4PTGER2PTGER3KCNH2
SCHEMBL18123935 0.79 PTGER4 (1.00) PTGER4PTGER2PTGER3KCNH2
SCHEMBL15549258 0.79 PTGER4 (1.00) PTGER4PTGER2PTGER3KCNH2

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
CN-107802623-B Difluorolactam compositions for EP 4-mediated bone-related diseases and disorders 开曼化学股份有限公司 2020-10-30 — — CN disclosed
CN-106748951-B Difluorolactam compounds as EP4 receptor selective agonists for use in the treatment of EP4 mediated diseases and conditions 开曼化学股份有限公司 2020-07-24 — — CN disclosed
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