SCHEMBL1784324

SCHEMBL1784324

CC(C)CC(C)CCCC=O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.48
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.35
TRPV1 Q8NER1 2/20 0.34
FAAH O00519 2/20 0.33
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.31
BLM P54132 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
SCHEMBL20362635 0.96 HIF1A (0.43) HIF1ATSHRLMNATRPV1FAAH
SCHEMBL1782964 0.93 HIF1A (0.46) HIF1ATSHRLMNATRPV1FAAH
SCHEMBL1784052 0.87 HIF1A (0.40) HIF1ATSHRADH1BADH1CADH1A
SCHEMBL3408019 0.85 HIF1A (0.45) HIF1ATSHRLMNATRPV1FAAH
SCHEMBL1782961 0.82 HIF1A (0.43) HIF1ATSHRTRPV1FAAHALDH1A1
SCHEMBL28922962 0.81 LMNA (0.59) HIF1ATSHRLMNATRPV1FAAH
SCHEMBL585190 0.81 LMNA (0.59) HIF1ATSHRLMNATRPV1FAAH
SCHEMBL1782837 0.81 LMNA (0.46) HIF1ATSHRLMNATRPV1FAAH
SCHEMBL15625952 0.80 HIF1A (0.42) HIF1ATSHRTRPV1FAAHALDH1A1
SCHEMBL214883 0.80 HIF1A (0.33) HIF1AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160326278-A1 AMINATION OF POLYMERS TERMINATED WITH ALDEHYDE GROUP AND THEIR FUNCTIONALIZED DERIVATIVES FOR FOULING MITIGATION IN HYDROCARBON REFINING PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2016-11-10 US disclosed
US-20160326278-A1 AMINATION OF POLYMERS TERMINATED WITH ALDEHYDE GROUP AND THEIR FUNCTIONALIZED DERIVATIVES FOR FOULING MITIGATION IN HYDROCARBON REFINING PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2016-11-10 US disclosed
US-20160160071-A1 Water-Based Polyolefin Corrosion Inhibitors Based on Vinyl/Vinylidene Terminated Polyolefins EXXONMOBIL CHEMICAL PATENTS INC. 2016-06-09 US disclosed
US-20140275433-A1 AMINATION OF POLYMERS TERMINATED WITH ALDEHYDE GROUP AND THEIR FUNCTIONALIZED DERIVATIVES FOR FOULING MITIGATION IN HYDROCARBON REFINING PROCESSES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2014-09-18 US disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
CN-101583587-B Process for preparing polyalcohols from formaldehyde with a low formic acid content BASF SE 2012-08-08 CN disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
CN-101583587-A Process for preparing polyalcohols from formaldehyde with a low formic acid content BASF SE (DE) 2009-11-18 CN disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 WO disclosed
US-7462747-B2 of by-products can advantageously be prevented in a targeted manner and the yield of the desired polymethylol compound can thereby be increased; condensing an aldehyde with formaldehyde in an aldol reaction to form an alkanal, hydrogenating the alkanal BASF AKTIENGESELLSCHAFT (DE) 2008-12-09 US disclosed
US-20080167506-A1 of by-products can advantageously be prevented in a targeted manner and the yield of the desired polymethylol compound can thereby be increased; condensing an aldehyde with formaldehyde in an aldol reaction to form an alkanal, hydrogenating the alkanal BASF AKTIENGESELLSCHAFT (DE) 2008-07-10 US disclosed
US-7186782-B2 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2007-03-06 US disclosed
US-20060041079-A1 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION 2006-02-23 US disclosed
US-6881797-B2 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2005-04-19 US disclosed
US-20040082727-A1 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (CN) 2004-04-29 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-20080167506-A1 of by-products can advantageously be prevented in a targeted manner and the yield of the desired polymethylol compound can thereby be increased; condensing an aldehyde with formaldehyde in an aldol reaction to form an alkanal, hydrogenating the alkanal ASH2L, AKR7A2, HACL2 HIF1A 1662/4885TSHR 4634/4885LMNA 1141/4885
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 HIF1A 1980/4885TSHR 2479/4885LMNA 1708/4885

“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.