SCHEMBL7429001

SCHEMBL7429001

CCOC(=O)C1COC(C(Cl)Cl)=N1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.41
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33
TSHR P16473 1/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
HSD17B10 Q99714 2/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPC1 O15118 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
SCHEMBL1180795 0.83 CCR3 (0.31) CCR3
SCHEMBL6602372 0.79 PPM1B (0.37) CCR3PPM1BPTPN1PPP1CCTSHR
SCHEMBL9744206 0.76 CCR3 (0.36) CCR3ALDH1A1
Hydrochloric Acid SCHEMBL7430476 0.75
SCHEMBL2471418 0.70 ALDH1A1 (0.34) ALDH1A1MAPTHSD17B10KDM4EMEN1
SCHEMBL9787827 0.70 ALDH1A1 (0.39) ALDH1A1
SCHEMBL22700052 0.70 TSHR (0.44) TSHR
SCHEMBL31429546 0.70
SCHEMBL15867713 0.67 ALDH1A1 (0.42) CCR3TSHRALDH1A1KMT2A
SCHEMBL31429466 0.65 KDM4E (0.45) ALDH1A1MAPTKDM4EMEN1KMT2A

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
WO-2000053589-A1 PROCESS FOR PREPARING OXAZOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 2000-09-14 WO disclosed