SCHEMBL728057

SCHEMBL728057

CCCCCC(C)N(C)C=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.44
ADH1C P00326 1/20 0.44
ADH1A P07327 1/20 0.44
ADH4 P08319 1/20 0.44
ADH7 P40394 1/20 0.44
OPRM1 P35372 1/20 0.39
TRPA1 O75762 1/20 0.38
DDAH1 O94760 1/20 0.38
GAPDH P04406 1/20 0.38
MAPT P10636 1/20 0.38
CA1 P00915 2/20 0.38
TP53 P04637 1/20 0.36
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
FDPS P14324 1/20 0.34
ACE2 Q9BYF1 1/20 0.34

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
SCHEMBL18998303 0.98 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL270377 0.93 TSHR (0.41) ADH1BADH1CADH1AADH4ADH7
SCHEMBL270914 0.84
SCHEMBL23188220 0.81 GSR (0.33)
SCHEMBL277272 0.80 TSHR (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL14213344 0.78 ADH1C (0.44) ADH1BADH1CADH1AADH4ADH7
SCHEMBL314509 0.78 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL276686 0.78 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL28009314 0.78 ADH1B (0.48) ADH1BADH1CADH1AADH4ADH7
SCHEMBL19494120 0.76 ADH1C (0.39) 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 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4746242-B2 2011-08-10 JP claimed
JP-4681192-B2 2011-05-11 JP claimed
EP-1250305-B1 WASTE WATER TREATMENT IN A METHOD FOR PRODUCING FORMIC ACID WHICH IS FREE OF WATER BASF SE (DE) 2009-08-12 EP claimed
EP-1250307-B1 UTILIZATION OF AN EXTRACTING AGENT AS ANTIFOAMING AGENT IN THE PRODUCTION OF ANHYDROUS FORMIC ACID BASF SE (DE) 2008-05-21 EP claimed
CN-100345813-C Apparatus and method for preparing anhydrous formic acid BASF AG (DE) 2007-10-31 CN claimed
US-7241365-B2 Material for a facility for the production of anhydrous formic acid BASF AKTIENGESELLSCHAFT (DE) 2007-07-10 US claimed
CN-1271033-C Utilization of extracting agent as antifoaming agent in production of anhydrous formic acid BASF AG (DE) 2006-08-23 CN claimed
CN-1271034-C Wastewater treatment in a process for the preparation of anhydrous formic acid BASF AG (DE) 2006-08-23 CN claimed
EP-1254099-B1 PROCESS FOR THE PRODUCTION OF ANHYDROUS FORMIC ACID BASF AG (DE) 2006-04-26 EP claimed
EP-1250306-B1 METHOD FOR CLEANING OFF-GAS FLOWS BASF AG (DE) 2005-11-09 EP claimed
CN-1395553-A Use of an extraction agent as a defoamer in the preparation of anhydrous formic acid BASF AG (DE) 2003-02-05 CN claimed
US-20030009057-A1 Utilization of an extracting agent as antifoaming agent in the production of anhydrous formic acid BASF AKTIENGESELLSCHAFT (DE) 2003-01-09 US claimed
EP-1254099-A2 PROCESS FOR THE PRODUCTION OF ANHYDROUS FORMIC ACID BASF AKTIENGESELLSCHAFT (DE) 2002-11-06 EP claimed
EP-1250306-A2 METHOD FOR CLEANING OFF-GAS FLOWS BASF AKTIENGESELLSCHAFT (DE) 2002-10-23 EP claimed
EP-1250305-A2 WASTE WATER TREATMENT IN A METHOD FOR PRODUCING FORMIC ACID WHICH IS FREE OF WATER BASF AKTIENGESELLSCHAFT (DE) 2002-10-23 EP claimed
EP-1250307-A1 UTILIZATION OF AN EXTRACTING AGENT AS ANTIFOAMING AGENT IN THE PRODUCTION OF ANHYDROUS FORMIC ACID BASF AKTIENGESELLSCHAFT (DE) 2002-10-23 EP claimed
WO-2001055069-A2 WASTE WATER TREATMENT IN A METHOD FOR PRODUCING FORMIC ACID WHICH IS FREE OF WATER BASF AKTIENGESELLSCHAFT (DE) 2001-08-02 WO claimed
WO-2001055071-A1 UTILIZATION OF AN EXTRACTING AGENT AS ANTIFOAMING AGENT IN THE PRODUCTION OF ANHYDROUS FORMIC ACID BASF AKTIENGESELLSCHAFT (DE) 2001-08-02 WO claimed
WO-2001055070-A2 METHOD FOR CLEANING OFF-GAS FLOWS BASF AKTIENGESELLSCHAFT (DE) 2001-08-02 WO claimed
WO-2001055077-A2 FACILITY AND METHOD FOR THE PRODUCTION OF ANHYDROUS FORMIC ACID BASF AKTIENGESELLSCHAFT (DE) 2001-08-02 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20030009057-A1 Utilization of an extracting agent as antifoaming agent in the production of anhydrous formic acid F2, ACSL3, ACSL1 ADH1B 1131/4885ADH1C 196/4885ADH1A 72/4885

“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.