SCHEMBL9832203

SCHEMBL9832203

CCCCCOC(=O)C(CCCN)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.43
HTR2C P28335 1/20 0.42
HCAR2 Q8TDS4 2/20 0.42
NOD1 Q9Y239 3/20 0.42
MAPT P10636 1/20 0.42
EPHX1 P07099 1/20 0.41
TSHR P16473 2/20 0.40
GPR84 Q9NQS5 3/20 0.39
FFAR1 O14842 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CPB2 Q96IY4 1/20 0.38
LCK P06239 1/20 0.38
PPARD Q03181 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38

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
SCHEMBL9830216 0.95 MAPT (0.44) NAAAHTR2CHCAR2NOD1MAPT
SCHEMBL2123199 0.95 ALDH1A1 (0.44) HCAR2NOD1MAPTTSHRALDH1A1
SCHEMBL9184074 0.93 MAPT (0.47) NAAAHTR2CHCAR2NOD1MAPT
SCHEMBL9362410 0.93 MAPT (0.47) NAAAHTR2CHCAR2NOD1MAPT
SCHEMBL7996533 0.90 GSR (0.44) HCAR2MAPTGPR84FFAR1ALDH1A1
SCHEMBL251336 0.89 NAAA (0.48) NAAAHCAR2NOD1MAPTEPHX1
SCHEMBL7449124 0.88 MAPT (0.44) MAPTGPR84FFAR1ALDH1A1CPB2
SCHEMBL4949251 0.87 MAPT (0.55) NAAAHCAR2NOD1MAPTEPHX1
SCHEMBL10523806 0.87 MAPT (0.55) NAAAHCAR2NOD1MAPTEPHX1
SCHEMBL9363102 0.86 NAAA (0.47) NAAAHTR2CEPHX1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed