SCHEMBL18514830

SCHEMBL18514830

CCOc1cccc(NC(=S)OC)c1COc1cc(C)c(CC)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.39
ALDH1A1 P00352 8/20 0.38
GAA P10253 4/20 0.38
MAPT P10636 3/20 0.38
ALOX12 P18054 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 4/20 0.36
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 2/20 0.35
NPC1 O15118 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL18514839 0.94 MEN1 (0.38) LMNAALDH1A1GAAMAPTALOX12
SCHEMBL18749006 0.92 LMNA (0.41) LMNAALDH1A1GAAMAPTALOX12
SCHEMBL18514261 0.91 ALDH1A1 (0.39) LMNAALDH1A1GAAMAPTALOX12
SCHEMBL18515444 0.91 ALDH1A1 (0.39) LMNAALDH1A1GAAMAPTALOX12
SCHEMBL18514838 0.91 LMNA (0.37) LMNAALDH1A1GAAMAPTALOX12
SCHEMBL18514846 0.91 LMNA (0.35) LMNAALDH1A1GAAMAPTALOX12
SCHEMBL18514847 0.91 LMNA (0.35) LMNAALDH1A1GAAMAPTALOX12
SCHEMBL18514975 0.89 LMNA (0.40) LMNAALDH1A1GAAMAPTALOX12
SCHEMBL18514837 0.88 ALDH1A1 (0.39) LMNAALDH1A1GAAMAPTNPSR1
SCHEMBL18514825 0.88 ALDH1A1 (0.37) LMNAALDH1A1GAAMAPTPOLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9788547-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
EP-3130584-A1 AROMATIC COMPOUND AND USES THEREOF Sumitomo Chemical Company Limited (JP) 2017-02-15 EP 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 (2 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-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-0 LMNA 2808/4885ALDH1A1 1238/4885GAA 3081/4885
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-10 LMNA 3163/4885ALDH1A1 1416/4885GAA 3763/4885

“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.