SCHEMBL9373441

SCHEMBL9373441

CC(=O)C(C)CCc1nccn1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.34
FPR2 P25090 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL9374488 0.87 SMN1; SMN2 (0.33) FDPSFPR2SMN1; SMN2PDE4APDE4B
SCHEMBL5133385 0.86 PDE4A (0.40) FDPSFPR2SMN1; SMN2PDE4APDE4B
SCHEMBL28701458 0.80 FDPS (0.39) FDPSSMN1; SMN2KMT2AMEN1
SCHEMBL9369991 0.75 FNTA (0.36) FDPSSMN1; SMN2PDE4APDE4BPDE4C
SCHEMBL1978411 0.74 AGTR1 (0.44) KMT2AMEN1POLBL3MBTL1
SCHEMBL21858158 0.74 FDPS (0.35) FDPS
SCHEMBL29269235 0.73 FDPS (0.33) FDPSSMN1; SMN2KMT2ANPC1POLB
SCHEMBL12467584 0.72 FDPS (0.35) FDPSKMT2ANPC1POLBL3MBTL1
SCHEMBL31754121 0.72 FDPS (0.35) FDPSSMN1; SMN2
SCHEMBL12480055 0.72 FDPS (0.35) FDPSSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343499-B1 3-Pyrrolidinylthio-1-azabicyclo(3,2,0) hept-2-ene-2-carboxylic acid compounds FUJISAWA PHARMACEUTICAL CO (JP) 1994-07-27 EP disclosed
US-5194624-A Treatent of infectious diseases in humans and animals FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-03-16 US disclosed
US-4963544-A THIENAMYCIN ANTIBIOTICS FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1990-10-16 US disclosed
EP-0343499-A1 3-Pyrrolidinylthio-1-azabicyclo(3,2,0) hept-2-ene-2-carboxylic acid compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-11-29 EP disclosed