SCHEMBL3886041

SCHEMBL3886041

CC[CH]C(C)CCCCCC

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
ADH1B P00325 1/20 0.43
ADH1C P00326 1/20 0.43
ADH1A P07327 1/20 0.43
ADH4 P08319 1/20 0.43
ADH7 P40394 1/20 0.43
SPHK1 Q9NYA1 1/20 0.41
LMNA P02545 1/20 0.41
DNM1 Q05193 2/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
ACE2 Q9BYF1 1/20 0.38
GPR84 Q9NQS5 3/20 0.37
FDPS P14324 3/20 0.37
FFAR1 O14842 1/20 0.37
CA1 P00915 1/20 0.37

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
SCHEMBL12484810 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL12483541 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL11291105 1.00 OPRM1 (0.44) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL3891492 0.97 OPRM1 (0.46) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL55980 0.90
SCHEMBL4663784 0.83 TSHR (0.42) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL9014021 0.83 TSHR (0.42) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL4037962 0.83 TSHR (0.42) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL13279660 0.83 TSHR (0.42) OPRM1ADH1BADH1CADH1AADH4
SCHEMBL17336107 0.83 TSHR (0.42) OPRM1ADH1BADH1CADH1AADH4

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4157360-B1 TCDTA-DERIVED FE(III) COMPLEXES FOR USE IN MAGNET RESONANCE IMAGING WITH LIVER AND KIDNEY EXCRETION UNIV BERLIN CHARITE (DE) 2024-02-28 EP disclosed
CN-116685409-A Method for flotation of silicate-containing iron ore 巴斯夫欧洲公司 2023-09-01 CN disclosed
EP-4011859-B1 METHOD FOR CHEMICAL STORAGE OF HYDROGEN APEX ENERGY TETEROW GMBH (DE) 2023-08-30 EP disclosed
CN-116669858-A Method for flotation of silicate-containing iron ore 巴斯夫欧洲公司 2023-08-29 CN disclosed
WO-2023151775-A1 A PROCESS FOR REVERSIBLE HYDROGEN STORAGE VIA AMINO ACID FORMATE ION PAIRS BY HYDROGENATION OF CARBON DIOXIDE APEX ENERGY TETEROW GMBH (DE) 2023-08-17 WO disclosed
EP-4045095-B1 IRON (III) COMPLEXES WITH NOVEL CONTRAST PROPERTIES FOR MAGNETIC RESONANCE IMAGING UNIV BERLIN CHARITE (DE) 2023-08-02 EP disclosed
EP-4157360-A1 TCDTA-DERIVED FE(III) COMPLEXES FOR USE IN MAGNET RESONANCE IMAGING WITH LIVER AND KIDNEY EXCRETION Charité - Universitätsmedizin Berlin (DE) 2023-04-05 EP disclosed
US-20220331454-A1 IRON(III) COMPLEXES HAVING NEW CONTRAST AGENT PROPERTIES, FOR MAGNETIC RESONANCE IMAGING CHARITÉ - UNIVERSITÄTSMEDIZIN BERLIN (DE) 2022-10-20 US disclosed
EP-4045095-A1 IRON(III) COMPLEXES HAVING NEW CONTRAST AGENT PROPERTIES, FOR MAGNETIC RESONANCE IMAGING Charité - Universitätsmedizin Berlin (DE) 2022-08-24 EP disclosed
WO-2022122522-A1 METHOD AND SYSTEM FOR CHEMICAL STORAGE OF HYDROGEN APEX ENERGY TETEROW GMBH (DE) 2022-06-16 WO disclosed
US-20140024741-A1 HIGH-LATENCY HARDENERS FOR EPOXY RESINS ALZCHEM AG (DE) 2014-01-23 US disclosed
US-20130323429-A1 NOVEL CURING AGENTS FOR EPOXY RESINS ALZCHEM AG (DE) 2013-12-05 US disclosed
CN-103261263-A Novel curing agents for epoxy resins ALZCHEM AG 2013-08-21 CN disclosed
WO-2012113878-A1 HIGH-LATENCY HARDENERS FOR EPOXY RESINS ALZCHEM AG (DE) 2012-08-30 WO disclosed
WO-2012113879-A1 NOVEL CURING AGENTS FOR EPOXY RESINS ALZCHEM AG (DE) 2012-08-30 WO disclosed
US-20090149584-A1 USE OF HEXAHYDROPHTHALIMIDE COMBINATIONS AS SOFTENER BASF AKTIENGESELLSCHAFT (DE) 2009-06-11 US disclosed
CN-101426843-A Use of hexahydrophthalimide combinations as softener BASF SE (DE) 2009-05-06 CN disclosed
EP-2013278-A1 USE OF HEXAHYDROPHTHALIMIDE COMBINATIONS AS SOFTENER BASF SE (DE) 2009-01-14 EP disclosed
WO-2008006834-A2 USE OF IMIDAZOLE COMPOUNDS AS PLASTICISERS BASF SE (DE) 2008-01-17 WO disclosed
WO-2007122204-A1 USE OF HEXAHYDROPHTHALIMIDE COMBINATIONS AS SOFTENER BASF SE (DE) 2007-11-01 WO 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 (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-20220331454-A1 IRON(III) COMPLEXES HAVING NEW CONTRAST AGENT PROPERTIES, FOR MAGNETIC RESONANCE IMAGING TFRC, SLC40A1, FTH1 OPRM1 1629/4885ADH1B 3539/4885ADH1C 2952/4885

“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.