SCHEMBL3788093

SCHEMBL3788093

CCCCCCCCCC(CCCCCC)(CCCCCC)OC(=O)OC(CCCCCC)(CCCCCC)CCCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.45
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GGPS1 O95749 6/20 0.43
SMPD1 P17405 2/20 0.42
FDPS P14324 8/20 0.42
EPHX1 P07099 2/20 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
SCHEMBL7782349 1.00 CES2 (0.45) CES2MEN1MAPTKMT2AATM
SCHEMBL11839460 1.00 CES2 (0.45) CES2MEN1MAPTKMT2AATM
SCHEMBL22117082 0.96 CES2 (0.42) CES2MEN1MAPTKMT2AATM
SCHEMBL27813236 0.91 FDPS (0.37) CES2MEN1MAPTKMT2AATM
SCHEMBL7621006 0.90 CES2 (0.41) CES2MEN1MAPTKMT2AATM
SCHEMBL141053 0.89 MEN1 (0.40) CES2MEN1MAPTKMT2AATM
SCHEMBL7621003 0.86 MEN1 (0.39) CES2MEN1MAPTKMT2AATM
SCHEMBL28473661 0.85 MEN1 (0.38) CES2MEN1MAPTKMT2AATM
SCHEMBL27833347 0.85 NAAA (0.44) CES2MEN1MAPTKMT2AATM
SCHEMBL11839463 0.84 CES2 (0.44) CES2MEN1KMT2AGGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10544086-B2 Dialkyl carbonates of branched alcohols and their use COGNIS IP MANAGEMENT GMBH (DE) 2020-01-28 US disclosed
US-20170260123-A1 DIALKYL CARBONATES OF BRANCHED ALCOHOLS AND THEIR USE COGNIS IP MANAGEMENT GMBH (DE) 2017-09-14 US disclosed
US-20100331565-A1 Dialkyl Carbonates of Branched Alcohols and their Use COGNIS IP MANAGEMENT GMBH (DE) 2010-12-30 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 (3 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-10544086-B2 Dialkyl carbonates of branched alcohols and their use ADH1C, ADH1A, GALK1 CES2 800/4885MEN1 1951/4885MAPT 2333/4885
US-20170260123-A1 DIALKYL CARBONATES OF BRANCHED ALCOHOLS AND THEIR USE ADH1C, ADH1A, GALK1 CES2 800/4885MEN1 1951/4885MAPT 2333/4885
US-20100331565-A1 Dialkyl Carbonates of Branched Alcohols and their Use GALK1, BCKDK, ADH1C CES2 573/4885MEN1 2748/4885MAPT 2323/4885

“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.