SCHEMBL6049347

SCHEMBL6049347

CC(C)(C)OC(=O)c1c[nH]c2ccc(CCCCCc3cccc(O)c3)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 7/20 0.44
GABRB2 P47870 7/20 0.44
GABRB1 P18505 4/20 0.44
GABRA3 P34903 4/20 0.44
GABRP O00591 3/20 0.44
GABRD O14764 3/20 0.44
GABRG2 P18507 3/20 0.44
GABRB3 P28472 3/20 0.44
GABRA5 P31644 3/20 0.44
GABRA2 P47869 3/20 0.44
GABRA4 P48169 3/20 0.44
GABRE P78334 3/20 0.44
GABRA6 Q16445 3/20 0.44
GABRG1 Q8N1C3 3/20 0.44
GABRG3 Q99928 3/20 0.44
GABRQ Q9UN88 3/20 0.44
TRPV1 Q8NER1 6/20 0.42
HDAC6 Q9UBN7 1/20 0.41
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL6049274 0.85 GABRA1 (0.40) GABRA1GABRB2GABRB1GABRA3GABRP
SCHEMBL6139981 0.84 GABRA1 (0.50) GABRA1GABRB2GABRB1GABRA3GABRP
SCHEMBL6648434 0.82 GABRA1 (0.46) GABRA1GABRB2
SCHEMBL6986923 0.81 NR4A2 (0.40) GABRA1GABRB2GABRB1GABRA3
SCHEMBL6991795 0.80 NR4A2 (0.51) NFKB1
SCHEMBL6990824 0.78 ALDH1A1 (0.39) GABRA1GABRB2
SCHEMBL6647509 0.78 NR4A2 (0.49) GABRA1GABRB2RAB9A
SCHEMBL6049346 0.77 SRC (0.47) HDAC6RAB9A
SCHEMBL4976948 0.75 ALDH1A1 (0.56)
SCHEMBL6676999 0.74 GABRA1 (0.47) GABRA1GABRB2

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-20060264480-A1 Novel thiocarbamic acid derivatives and the pharmaceutical compositions containing the same SUH YOUNG G 2006-11-23 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-20060264480-A1 Novel thiocarbamic acid derivatives and the pharmaceutical compositions containing the same TRPV1, TRPA1, TRPV5 GABRA1 346/4885GABRB2 231/4885GABRB1 192/4885

“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.