SCHEMBL18749006

SCHEMBL18749006

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

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.41
ALDH1A1 P00352 7/20 0.38
KMT2A Q03164 5/20 0.38
MAPT P10636 4/20 0.38
GAA P10253 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
ALOX12 P18054 3/20 0.38
HPGD P15428 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
PKM P14618 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
SCHEMBL18514830 0.92 LMNA (0.39) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18749037 0.90 ALDH1A1 (0.40) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18748981 0.89 SMN1; SMN2 (0.36) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18748935 0.89 LMNA (0.38) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18749087 0.88 MAPT (0.50) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18513920 0.87 MAPT (0.45) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18748977 0.87 ALDH1A1 (0.44) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18748995 0.87 ALDH1A1 (0.40) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18748864 0.87 LMNA (0.44) LMNAALDH1A1KMT2AMAPTGAA
SCHEMBL18749092 0.87 ALDH1A1 (0.39) LMNAALDH1A1KMT2AMAPTGAA

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-9907307-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-06 US disclosed
US-9788547-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 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 (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 1238/4885KMT2A 705/4885
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-10 LMNA 3163/4885ALDH1A1 1416/4885KMT2A 1447/4885

“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.