SCHEMBL6049301

SCHEMBL6049301

CC(C)(C)OC(=O)c1cc2cc(CCC(CCc3ccccc3)OC(=S)NCCc3ccccc3)ccc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
KDM4E B2RXH2 3/20 0.48
MAPT P10636 1/20 0.48
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
CNR1 P21554 1/20 0.38
CTSK P43235 1/20 0.38
CTNNB1 P35222 1/20 0.38
POLB P06746 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
SCHEMBL6049302 0.81 MEN1 (0.45) NPC1RAB9AMAPTPPARGPPARA
SCHEMBL6049275 0.72 GAA (0.53) MAPT
SCHEMBL6049253 0.72 PPARA (0.48) MAPTPPARGPPARA
SCHEMBL23466553 0.71 CTSS (0.55) CTSKCTNNB1
SCHEMBL24988007 0.71 ALDH1A1 (0.49) RAB9AMAPT
SCHEMBL5795136 0.71 KDM4E (0.48) NPC1RAB9AKDM4EMAPT
SCHEMBL6049346 0.71 SRC (0.47) RAB9AKDM4E
SCHEMBL6049308 0.70 MEN1 (0.46) MAPT
SCHEMBL6049411 0.70
SCHEMBL6049296 0.68 KMT2A (0.46) MAPTPPARGPPARA

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 NPC1 2332/4885RAB9A 1122/4885KDM4E 4307/4885
US-20030203944-A1 Novel thiocarbamic acid derivatives and the pharmaceutical compositions containing the same TRPV1, TRPA1, TRPV5 NPC1 2332/4885RAB9A 1122/4885KDM4E 4307/4885

“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.