SCHEMBL6049289

SCHEMBL6049289

CS(=O)(=O)Nc1ccccc1CCC(O)CCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 7/20 0.47
POLB P06746 1/20 0.45
ADRB2 P07550 3/20 0.44
ADRB1 P08588 3/20 0.44
TSHR P16473 1/20 0.43
NR3C1 P04150 5/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PGR P06401 1/20 0.43
NR3C2 P08235 1/20 0.43
AR P10275 1/20 0.43
KMT2A Q03164 1/20 0.42
CYP19A1 P11511 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL6049290 0.82 ADRB2 (0.53) ADRB3ADRB2ADRB1PGRNR3C2
SCHEMBL14131236 0.80 L3MBTL1 (0.53) NR3C1L3MBTL1PGRNR3C2AR
SCHEMBL8504965 0.79 L3MBTL1 (0.45) TSHRL3MBTL1KMT2AALDH1A1KDM4E
SCHEMBL14144377 0.79 L3MBTL1 (0.45) TSHRNR3C1L3MBTL1KMT2AALDH1A1
Benzene SCHEMBL3558153 0.76 SLC16A3 (0.63) ADRB3POLBTSHRNR3C1L3MBTL1
SCHEMBL3558898 0.76 SLC16A3 (0.63) ADRB3POLBTSHRNR3C1L3MBTL1
SCHEMBL13948485 0.76 KCNH2 (0.59) ADRB3
SCHEMBL6049304 0.75 ADRB3 (0.46) ADRB3POLBADRB2ADRB1NR3C1
SCHEMBL3715386 0.75 PLA2G7 (0.54) POLBTSHRNR3C1L3MBTL1KMT2A
SCHEMBL8867626 0.74 PIK3CG (0.49) NR3C1L3MBTL1KMT2AALDH1A1KDM4E

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 5 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
EP-1311477-A4 NOVEL THIOCARBAMIC ACID DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORP (KR) 2005-01-12 EP disclosed
US-20030203944-A1 Novel thiocarbamic acid derivatives and the pharmaceutical compositions containing the same PACIFIC CORPORATION (KR) 2003-10-30 US disclosed
EP-1311477-A1 NOVEL THIOCARBAMIC ACID DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORPORATION (KR) 2003-05-21 EP disclosed
WO-2002016317-A1 NOVEL THIOCARBAMIC ACID DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORPORATION (KR) 2002-02-28 WO 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 ADRB3 1003/4885POLB 4004/4885ADRB2 563/4885
US-20030203944-A1 Novel thiocarbamic acid derivatives and the pharmaceutical compositions containing the same TRPV1, TRPA1, TRPV5 ADRB3 1003/4885POLB 4004/4885ADRB2 563/4885

“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.