SCHEMBL9700328

SCHEMBL9700328

CCC(NC(=O)C(=O)O)N(CC)CC

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
KCNH2 Q12809 1/20 0.32
FDPS P14324 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL9702897 0.81 USP2 (0.32)
SCHEMBL3280973 0.80 TGFBR1 (0.43)
Hydrochloric Acid SCHEMBL29162350 0.79 TGFBR1 (0.42)
SCHEMBL9729535 0.77 CA1 (0.34) FDPS
SCHEMBL9701318 0.77 PGR (0.36) PGRADRA2AADRA2BHTR2AHRH1
Hydrochloric Acid SCHEMBL9701574 0.75 PGR (0.35) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL8145684 0.74 TGFBR1 (0.39)
SCHEMBL3285064 0.72 TSHR (0.47) ALDH1A1
Hydrochloric Acid SCHEMBL29008141 0.71 TSHR (0.45) ALDH1A1
SCHEMBL7401448 0.69 KMT2A (0.38) ALDH1A1

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
US-5132454-A Antihypoxic agents MEIJI SEIKA KAISHA, LTD. (JP) 1992-07-21 US disclosed
US-5066677-A Antihypoxic agents, treatment of disorders resulting from reduced oxygen supply to brain MEIJI SEIKA KAISHA, LTD. (JP) 1991-11-19 US disclosed
EP-0387074-A2 Novel oxamic acid compounds and pharmaceutical composition for use in improvement of damaged cerebral functions of brain MEIJI SEIKA KAISHA LTD. (JP) 1990-09-12 EP disclosed