SCHEMBL4879429

SCHEMBL4879429

CCOC(=O)c1cn2c3c(cc(SCCNC(=O)OC(C)(C)C)cc3c1=O)OCCC2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
HPGD P15428 4/20 0.34
HSD17B10 Q99714 4/20 0.34
KDM4E B2RXH2 3/20 0.34
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 3/20 0.32
MAPT P10636 2/20 0.32
TSHR P16473 2/20 0.32
BRD4 O60885 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADRB2 P07550 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
CASP1 P29466 1/20 0.31
RAB9A P51151 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
SCHEMBL4172529 0.86 BRD4 (0.35) ALDH1A1HPGDHSD17B10KDM4ELMNA
SCHEMBL4180098 0.82 DDB1 (0.37) ALDH1A1HPGDHSD17B10KDM4ETDP1
SCHEMBL4135830 0.77 KDM4E (0.42) ALDH1A1HPGDHSD17B10KDM4ETDP1
SCHEMBL4135833 0.77 KDM4E (0.42) ALDH1A1HPGDHSD17B10KDM4ETDP1
SCHEMBL4175922 0.76 KDM4E (0.42) ALDH1A1HPGDHSD17B10KDM4ETDP1
SCHEMBL4887129 0.76 KDM4E (0.44) ALDH1A1HPGDHSD17B10KDM4ETDP1
SCHEMBL4178090 0.75 SIGMAR1 (0.37) ALDH1A1L3MBTL1BRD4MEN1KMT2A
SCHEMBL4178092 0.74 SIGMAR1 (0.35) ALDH1A1HPGDHSD17B10KDM4EL3MBTL1
SCHEMBL3816675 0.73 LMNA (0.55) ALDH1A1HPGDHSD17B10KDM4ETDP1
SCHEMBL3981476 0.73 MTNR1A (0.42) ALDH1A1KDM4EMAPTMAPK1ADRB2

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-20080096829-A1 Macrolone Compounds GLAXO GROUP LIMITED (GB) 2008-04-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080096829-A1 Macrolone Compounds MRPL21, MRPS18A, MRPL19 ALDH1A1 3772/4885HPGD 2304/4885HSD17B10 344/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.