SCHEMBL9304121

SCHEMBL9304121

CCC(C)N[C@@H](C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.44
ACE P12821 1/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
ALDH1A1 P00352 3/20 0.36
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RAB9A P51151 1/20 0.35
TP53 P04637 1/20 0.35
HCAR3 P49019 2/20 0.34
MAPT P10636 1/20 0.34
CHRM1 P11229 1/20 0.33
AKR1A1 P14550 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33

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
SCHEMBL19209687 1.00 MME (0.44) MMEACECPA1ACE2MMP1
SCHEMBL19209666 1.00 MME (0.44) MMEACECPA1ACE2MMP1
SCHEMBL9304116 1.00 MME (0.44) MMEACECPA1ACE2MMP1
SCHEMBL13889267 0.81 CHRM1 (0.46) MMEACECPA1ACE2ALDH1A1
SCHEMBL20981441 0.81 CHRM1 (0.46) MMEACECPA1ACE2ALDH1A1
SCHEMBL19209635 0.80 MME (0.48) MMEACECPA1ACE2MMP1
SCHEMBL2557833 0.80 OR51E2 (0.36) MMEACECPA1ACE2TP53
SCHEMBL13484585 0.80 MMP1 (0.40) MMEACECPA1ACE2MMP1
SCHEMBL10208032 0.80 OR51E2 (0.36) MMEACECPA1ACE2TP53
SCHEMBL10208031 0.80 OR51E2 (0.36) MMEACECPA1ACE2TP53

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
US-5350808-A Reacting acrylate polymers with ammonia and and primary amines BASF AKTIENGESELLSCHAFT (DE) 1994-09-27 US disclosed