SCHEMBL7536787

SCHEMBL7536787

CC(=O)N(c1ccc(CCC(=O)O)cc1)N1CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.41
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
ITGB3 P05106 2/20 0.39
ITGA2B P08514 2/20 0.39
KEAP1 Q14145 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
FFAR4 Q5NUL3 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
KMT2A Q03164 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP26A1 O43174 1/20 0.36
CYP26B1 Q9NR63 1/20 0.36

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
SCHEMBL7538929 0.88 AOC3 (0.37) LMNAITGB3ITGA2BKMT2A
Hydrochloric Acid SCHEMBL7538675 0.86 FKBP1A (0.43) GAAHRH3L3MBTL1KMT2A
SCHEMBL7544912 0.84 CYP4A11 (0.38) LMNAKMT2ACA2
SCHEMBL8325473 0.84 FFAR1 (0.44) FFAR1ITGB3ITGA2BKEAP1FFAR4
SCHEMBL7540020 0.83 FKBP1A (0.55) KMT2A
SCHEMBL7536716 0.83 KMT2A (0.33) KMT2A
SCHEMBL7538015 0.81 FKBP1A (0.32) KMT2A
SCHEMBL5717885 0.80 SIGMAR1 (0.45) KMT2AHSD17B10
Hydrochloric Acid SCHEMBL5849112 0.79 SIGMAR1 (0.44) KMT2AHSD17B10
SCHEMBL8930521 0.76 GFER (0.36) L3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1211249-A1 NOVEL THIAZINE OR PYRAZINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-06-05 EP disclosed