SCHEMBL9201254

SCHEMBL9201254

C=CCOC(=O)N1C[C@@H](SC(c2ccccc2)(c2ccccc2)c2ccccc2)C[C@H]1/C=C\C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.38
FAAH O00519 3/20 0.36
LMNA P02545 3/20 0.35
MAPK1 P28482 2/20 0.35
RAB9A P51151 1/20 0.35
MGLL Q99685 1/20 0.34
CYP19A1 P11511 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
F2 P00734 3/20 0.32
ELANE P08246 3/20 0.32
CTSG P08311 2/20 0.32
CYP3A4 P08684 2/20 0.32
PARP1 P09874 1/20 0.31
AGTR2 P50052 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
KDM4E B2RXH2 2/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
SLC6A1 P30531 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
SCHEMBL9201263 1.00 CHRM1 (0.38) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9197605 0.92 CHRM1 (0.37) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9197532 0.92 CHRM1 (0.37) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9196475 0.92 CHRM1 (0.37) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9198124 0.90 CHRM1 (0.40) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9199090 0.90 CHRM1 (0.35) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9020479 0.90 L3MBTL1 (0.37) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9020483 0.90 L3MBTL1 (0.37) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9199097 0.90 CHRM1 (0.35) CHRM1FAAHLMNAMAPK1RAB9A
SCHEMBL9198261 0.90 CHRM1 (0.37) CHRM1FAAHLMNAMAPK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411664-B1 2-(2-Vinylpyrrolidinylthio)carbapenem derivatives BANYU PHARMA CO LTD (JP) 1995-01-18 EP disclosed
WO-1993001192-A1 2-(2-SUBSTITUTED PYRROLIDINYLTHIO)CARBAPENEM DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-01-21 WO disclosed
EP-0522504-A1 2-(2-substituted pyrrolidinylthio)-carbapenem derivatives Banyu Pharmaceutical Co., Ltd. (JP) 1993-01-13 EP disclosed
US-5095013-A Antibiotics BANYU PHARMACEUTICAL CO., LTD. (JP) 1992-03-10 US disclosed
EP-0411664-A2 2-(2-Vinylpyrrolidinylthio)carbapenem derivatives Banyu Pharmaceutical Co., Ltd. (JP) 1991-02-06 EP disclosed