SCHEMBL3837639

SCHEMBL3837639

CCCCCCCCCCCC(=O)C(CCCCCCCCC)NCC(O)CO

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.46
FFAR1 O14842 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.45
DUSP3 P51452 1/20 0.45
LMNA P02545 1/20 0.45
GPR84 Q9NQS5 3/20 0.44

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
SCHEMBL116561 0.89 MEN1 (0.46) MEN1KMT2AKDM4EDUSP3LMNA
SCHEMBL738858 0.89 MEN1 (0.46) MEN1KMT2AKDM4EDUSP3LMNA
SCHEMBL115573 0.89 MEN1 (0.46) MEN1KMT2AKDM4EDUSP3LMNA
SCHEMBL7906858 0.79 FFAR4 (0.44) FFAR4FFAR1MEN1KMT2AKDM4E
SCHEMBL2638784 0.79 FFAR4 (0.44) FFAR4FFAR1MEN1KMT2AKDM4E
SCHEMBL24753529 0.75 LMNA (0.47) FFAR4FFAR1MEN1KMT2AKDM4E
SCHEMBL116650 0.74 CES2 (0.47) MEN1KMT2A
Glycerin SCHEMBL11503607 0.74 FFAR4 (0.56) FFAR4FFAR1MEN1KMT2AKDM4E
SCHEMBL115181 0.74 CES2 (0.47) MEN1KMT2A
SCHEMBL737893 0.74 CES2 (0.47) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10098841-B2 Method of inducing a phase transition of a bilayer membrane vesicle JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2018-10-16 US disclosed
EP-1852177-B1 MOLECULAR AGGREGATE CAPABLE OF UNDERGOING PHASE TRANSITION BY DEHYDRATING CONDENSATION AND METHOD OF PHASE TRANSITION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2014-02-26 EP disclosed
EP-2669002-A1 Molecular aggregate capable of undergoing phase transition by dehydrating condensation and method of phase transition thereof Japan Science and Technology Agency (JP) 2013-12-04 EP disclosed
US-20130251788-A1 Method of Inducing a Phase Transition of a Bilayer Membrane Vesicle JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2013-09-26 US disclosed
US-8449979-B2 Molecular aggregate capable of undergoing phase transition by dehydrating condensation and method of phase transition thereof JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2013-05-28 US disclosed
US-20090023003-A1 Molecular Aggregate Capable of Undergoing Phase Transition by Dehydrating Condensation and Method of Phase Transition Thereof JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-01-22 US disclosed
EP-1852177-A1 MOLECULAR AGGREGATE CAPABLE OF UNDERGOING PHASE TRANSITION BY DEHYDRATING CONDENSATION AND METHOD OF PHASE TRANSITION THEREOF Japan Science and Technology Agency (JP) 2007-11-07 EP 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-10098841-B2 Method of inducing a phase transition of a bilayer membrane vesicle VAPB, VAPA, NSF FFAR4 512/4885FFAR1 455/4885MEN1 3215/4885
US-20130251788-A1 Method of Inducing a Phase Transition of a Bilayer Membrane Vesicle VAPB, VAPA, NSF FFAR4 512/4885FFAR1 455/4885MEN1 3215/4885

“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.