SCHEMBL1619643

SCHEMBL1619643

CCCCCCCC(C)NCCO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.47
ADH1C P00326 1/20 0.47
ADH1A P07327 1/20 0.47
ADH4 P08319 1/20 0.47
ADH7 P40394 1/20 0.47
LMNA P02545 4/20 0.45
ADRB2 P07550 4/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 1/20 0.42
SPHK1 Q9NYA1 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
FAAH O00519 2/20 0.38
CYP2D6 P10635 2/20 0.38
GMNN O75496 1/20 0.38
POLB P06746 1/20 0.38
THPO P40225 1/20 0.38
MTOR P42345 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
SCHEMBL27493677 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL8750526 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL11466989 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL9321628 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL11801938 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL10711540 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL19923774 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL11801402 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1618180 0.98 ADH1B (0.44) ADH1BADH1CADH1AADH4ADH7
SCHEMBL7968807 0.91 ADRB2 (0.42) ADH1BADH1CADH1AADH4ADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1399409-B1 METHOD FOR PRODUCING (METH)ACRYLIC ACID ESTERS BASF SE (DE) 2012-10-31 EP claimed
US-7268251-B2 Method for producing (meth) acrylic acid esters BASF AKTIENGESELLSCHAFT (DE) 2007-09-11 US claimed
US-7026503-B2 Method for producing (meth)acrylic acid esters BASF AKTIENGESELLSCHAFT (DE) 2006-04-11 US claimed
EP-1399408-B1 METHOD FOR PRODUCING (METH)ACRYLIC ACID ESTERS BASF AG (DE) 2006-03-22 EP claimed
US-10174349-B2 Recombinant cell producing 2-hydroxyisobutyric acid EVONIK ROEHM GMBH (DE) 2019-01-08 US disclosed
EP-2782921-B1 ORGANIC TUNGSTEN COMPLEXES VANDERBILT CHEMICALS LLC (US) 2018-05-02 EP disclosed
EP-2782921-A1 ORGANIC TUNGSTEN COMPLEXES Vanderbilt Chemicals, LLC (US) 2014-10-01 EP disclosed
CN-103958536-A Organic tungsten complexes VANDERBILT CHEMICALS LLC 2014-07-30 CN disclosed
US-8669386-B2 Organic tungsten complexes VANDEBILT CHEMICALS, LLC (US) 2014-03-11 US disclosed
WO-2013077948-A1 ORGANIC TUNGSTEN COMPLEXES VANDERBILT CHEMICALS, LLC. (US) 2013-05-30 WO disclosed
US-20120165563-A1 ORGANIC TUNGSTEN COMPLEXES R.T. VANDERBILT COMPANY, INC. 2012-06-28 US disclosed
US-8207371-B2 Process for preparing (meth)acrylic acid EVONIK RÖHM GMBH (DE) 2012-06-26 US disclosed
US-20110171702-A1 RECOMBINANT CELL PRODUCING 2-HYDROXYISOBUTYRIC ACID EVONIK ROEHM GMBH (DE) 2011-07-14 US disclosed
US-7928251-B2 Process for preparing tetramethyl glycolide EVONIK ROEHM GMBH (DE) 2011-04-19 US disclosed
US-20100029979-A1 PROCESS FOR PREPARING (METH)ACRYLIC ACID EVONIK ROEHM GMBH (DE) 2010-02-04 US disclosed
US-20100010276-A1 PROCESS FOR PREPARING TETRAMETHYL GLYCOLIDE EVONIK ROEHM GMBH (DE) 2010-01-14 US disclosed
US-4223138-A VAPORIZATION, CONDENSATION, RETARDING FLOW TO REACTION ZONE BAYER AKTIENGESELLSCHAFT (DE) 1980-09-16 US disclosed
US-3977994-A Rust inhibiting composition UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-08-31 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-20100029979-A1 PROCESS FOR PREPARING (METH)ACRYLIC ACID MMAB, ASS1, PAM ADH1B 273/4885ADH1C 194/4885ADH1A 58/4885
US-20120165563-A1 ORGANIC TUNGSTEN COMPLEXES ADH5, ELOVL5, ALOX5 ADH1B 159/4885ADH1C 7/4885ADH1A 5/4885

“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.