SCHEMBL6049221

SCHEMBL6049221

COc1cc(OCC(C)OC(=S)NCCc2ccccc2)ccc1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ADRB2 P07550 2/20 0.39
ADRB1 P08588 1/20 0.39
PLAAT3 P53816 1/20 0.39
PLAAT5 Q96KN8 1/20 0.39
PLAAT2 Q9NWW9 1/20 0.39
PLAAT4 Q9UL19 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
ALOX12 P18054 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL6049319 0.79 KMT2A (0.47) HPGDMEN1KMT2APLAAT3PLAAT5
SCHEMBL6049285 0.74 DRD2 (0.42) KMT2AADRB2ADRB1CYP2D6
SCHEMBL6049261 0.72 MEN1 (0.47) MEN1KMT2APLAAT3PLAAT5PLAAT2
SCHEMBL6049308 0.68 MEN1 (0.46) MEN1KMT2A
SCHEMBL6049294 0.67 DRD2 (0.43) GAAKMT2AADRB2PLAAT3PLAAT5
SCHEMBL12120169 0.67 DRD2 (0.43)
SCHEMBL6140314 0.66 DRD2 (0.47) GAAKMT2APLAAT3PLAAT5PLAAT2
SCHEMBL13640332 0.66 CA12 (0.59) GAAMEN1KMT2ACYP1A2CYP3A4
SCHEMBL6049293 0.65 DRD2 (0.43) GAA
SCHEMBL7713701 0.64 GSK3B (0.57) HPGDCYP1A2

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 2 patents. 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
US-20030203944-A1 Novel thiocarbamic acid derivatives and the pharmaceutical compositions containing the same PACIFIC CORPORATION (KR) 2003-10-30 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-20060264480-A1 Novel thiocarbamic acid derivatives and the pharmaceutical compositions containing the same TRPV1, TRPA1, TRPV5 GAA 2336/4885HPGD 584/4885MEN1 3797/4885
US-20030203944-A1 Novel thiocarbamic acid derivatives and the pharmaceutical compositions containing the same TRPV1, TRPA1, TRPV5 GAA 2336/4885HPGD 584/4885MEN1 3797/4885

“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.