SCHEMBL6575753

SCHEMBL6575753

NCCCOC1CCCCO1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4C Q9H3R0 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
ODC1 P11926 1/20 0.30

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
SCHEMBL8971720 0.96 MEN1 (0.48) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL31749258 0.95 MEN1 (0.45) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL26157632 0.94 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6953888 0.94 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL25865981 0.94 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL14389110 0.94 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6952808 0.94 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL20977729 0.94 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6947738 0.94 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL11024894 0.90 MEN1 (0.54) MEN1KMT2AKDM4CL3MBTL1NPC1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHAMACEUTICALS (US) 2010-06-10 US disclosed
EP-1241164-B1 PROCESS FOR PREPARATION OF TETRAHYDROPYRANYLOXYAMINES MITSUBISHI RAYON CO (JP) 2004-05-06 EP disclosed
US-20040030160-A1 Process for preparation of tetrahydropyranyoxyamines MITSUBISHI RAYON CO., LTD. (JP) 2004-02-12 US disclosed
EP-1241164-A1 PROCESS FOR PREPARATION OF TETRAHYDROPYRANYLOXYAMINES Mitsubishi Rayon Co., Ltd. (JP) 2002-09-18 EP disclosed
EP-0009776-B1 N-MONOHYDROXYPROPYLAMIDES, N-DIHYDROXYPROPYLAMIDES AND THEIR ACETONOIDES OF ALL-E AND 13-Z RETINOIC ACID, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BASF Aktiengesellschaft (DE) 1982-07-28 EP disclosed
EP-0009776-A1 N-monohydroxypropylamides, N-dihydroxypropylamides and their acetonoides of all-E and 13-Z retinoic acid, process for their preparation and pharmaceutical compositions containing them BASF Aktiengesellschaft (DE) 1980-04-16 EP disclosed
US-4167632-A APPETITE SUPPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1979-09-11 US disclosed
US-4122265-A APPETITE SUPPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1978-10-24 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-20040030160-A1 Process for preparation of tetrahydropyranyoxyamines PNMT, HRH4, HRH1 MEN1 3101/4885KMT2A 1802/4885KDM4C 1847/4885
US-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS PDK1, PDK2, PDK3 MEN1 1555/4885KMT2A 1202/4885KDM4C 1275/4885

“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.