SCHEMBL7765715

SCHEMBL7765715

CCCNC(=O)[C@H](Cc1ccccc1)NC(=O)C1OC1C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 2/20 0.54
CHRNB2 P17787 1/20 0.52
CHRNB4 P30926 1/20 0.52
CHRNA3 P32297 1/20 0.52
CHRNA4 P43681 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.50
CPB2 Q96IY4 2/20 0.48
CPB1 P15086 1/20 0.48
CHRND Q07001 7/20 0.48
CHRNA1 P02708 3/20 0.48
CHRNG P07510 3/20 0.48
CHRNB1 P11230 3/20 0.48
GNPAT O15228 1/20 0.47

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
Aniline SCHEMBL7764136 0.95 TLR2 (0.50) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7762775 0.93 CPB2 (0.49) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7758999 0.91 CALCRL (0.54) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
Aniline SCHEMBL7762808 0.89 CPB2 (0.46) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7759027 0.88 CPB2 (0.50) CPB2GNPAT
SCHEMBL7761873 0.87 GNPAT (0.52) CPB2CPB1GNPAT
Aniline SCHEMBL7762780 0.87 CALCRL (0.52) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7765746 0.85 NTMT1 (0.48) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
Hydrochloric Acid SCHEMBL7763474 0.85 NTMT1 (0.48) TLR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7759040 0.84 CPB2 (0.46) CPB2GNPAT

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-0808839-B1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO LTD (JP) 2001-05-23 EP disclosed
EP-0808839-A1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO., LTD. (JP) 1997-11-26 EP disclosed