SCHEMBL8065760

SCHEMBL8065760

CS/C(=N\C(=O)OC(C)(C)C)NN(C(N)=O)C(=O)OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 2/20 0.37
SYK P43405 1/20 0.37
LTA4H P09960 1/20 0.36
CTSL P07711 1/20 0.36
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
IDO1 P14902 1/20 0.34
CCR6 P51684 1/20 0.33
PAX8 Q06710 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
NCOR2 Q9Y618 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
SCHEMBL8065764 1.00 AKT1 (0.38) AKT1SMN1; SMN2ALDH1A1SYKLTA4H
SCHEMBL8063405 0.90 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1L3MBTL1POLBMAPT
SCHEMBL8063402 0.90 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1L3MBTL1POLBMAPT
SCHEMBL8063733 0.84 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL8063731 0.84 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL7342215 0.79 SYK (0.46) AKT1SMN1; SMN2ALDH1A1SYKLMNA
SCHEMBL7342211 0.79 SYK (0.46) AKT1SMN1; SMN2ALDH1A1SYKLMNA
SCHEMBL8068382 0.76 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1L3MBTL1MAPTHPGD
SCHEMBL31384541 0.76 RAB9A (0.46) AKT1SMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL8065769 0.75 SYK (0.43) AKT1SMN1; SMN2ALDH1A1SYKLMNA

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
US-6162925-A Antibiotic for methicillin resistant bacteria RESEARCH CORPORATION TECH., INC. (US) 2000-12-19 US disclosed
US-6110925-A EFFECTIVE AGAINST STAPHYLOCOCCUS; ANTITUMOR AGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 2000-08-29 US disclosed