SCHEMBL103165

SCHEMBL103165

CCCCCC(CCC)COCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
CYP3A4 P08684 4/20 0.41
OPRM1 P35372 1/20 0.41
ALDH1A1 P00352 4/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
TP53 P04637 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
TSHR P16473 2/20 0.32
ATM Q13315 1/20 0.32
DNM1 Q05193 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32

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
SCHEMBL13061573 0.98 LMNA (0.46) LMNACYP3A4OPRM1ALDH1A1CA12
SCHEMBL13972410 0.95 LMNA (0.46) LMNACYP3A4OPRM1ALDH1A1L3MBTL1
SCHEMBL19035589 0.93 LMNA (0.50) LMNACYP3A4OPRM1ALDH1A1L3MBTL1
SCHEMBL28169231 0.93 LMNA (0.50) LMNACYP3A4OPRM1ALDH1A1L3MBTL1
SCHEMBL13909185 0.93 LMNA (0.50) LMNACYP3A4OPRM1ALDH1A1L3MBTL1
SCHEMBL20253209 0.93 LMNA (0.50) LMNACYP3A4OPRM1ALDH1A1L3MBTL1
SCHEMBL3987510 0.91 LMNA (0.48) LMNACYP3A4OPRM1ALDH1A1L3MBTL1
SCHEMBL13972408 0.91 LMNA (0.48) LMNACYP3A4OPRM1ALDH1A1CA2
SCHEMBL101110 0.91 LMNA (0.46) LMNACYP3A4OPRM1ALDH1A1CA12
SCHEMBL20253213 0.88 LMNA (0.50) LMNACYP3A4OPRM1ALDH1A1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023161295-A1 CLEANING CONCENTRATE FOR TURBINE JET ENGINES, CLEANING SOLUTION AND USE THEREOF Alfred Kärcher SE & Co. KG (DE) 2023-08-31 WO claimed
WO-2023161295-A1 CLEANING CONCENTRATE FOR TURBINE JET ENGINES, CLEANING SOLUTION AND USE THEREOF Alfred Kärcher SE & Co. KG (DE) 2023-08-31 WO disclosed
WO-2023161295-A1 CLEANING CONCENTRATE FOR TURBINE JET ENGINES, CLEANING SOLUTION AND USE THEREOF Alfred Kärcher SE & Co. KG (DE) 2023-08-31 WO disclosed
EP-2473484-B1 ORGANOPHOSPHORUS COMPOUNDS BASED ON TETRAPHENOL (TP)-SUBSTITUTED STRUCTURES EVONIK DEGUSSA GMBH (DE) 2015-08-19 EP disclosed
EP-2886533-A1 Use of Organophosphorus compounds based on tetraphenol (TP)-substituted structures Evonik Degussa GmbH (DE) 2015-06-24 EP disclosed
US-8940943-B2 Cosmetic preparations COGNIS IP MANAGEMENT GMBH (DE) 2015-01-27 US disclosed
US-8940943-B2 Cosmetic preparations COGNIS IP MANAGEMENT GMBH (DE) 2015-01-27 US disclosed
EP-2132167-B1 METHOD FOR THE PRODUCTION OF beta-KETONITRILES BASF SE (DE) 2013-12-25 EP disclosed
US-8501748-B2 Method for the production of β-ketonitriles BASF SE (DE) 2013-08-06 US disclosed
EP-2601166-A1 COSMETIC PREPARATIONS Cognis IP Management GmbH (DE) 2013-06-12 EP disclosed
US-20130005970-A1 Method for the production of beta-ketonitriles BASF SE (DE) 2013-01-03 US disclosed
US-8309751-B2 Method for the production of β-ketonitriles BASF SE (DE) 2012-11-13 US disclosed
US-20120197025-A1 ORGANOPHOSPHORUS COMPOUNDS BASED ON TETRAPHENOL (TP)-SUBSTITUTED STRUCTURES EVONIK OXENO GMBH (DE) 2012-08-02 US disclosed
EP-2426101-A1 Cosmetic preparations Cognis IP Management GmbH (DE) 2012-03-07 EP disclosed
EP-2426101-A1 Cosmetic preparations Cognis IP Management GmbH (DE) 2012-03-07 EP disclosed
WO-2012016642-A1 COSMETIC PREPARATIONS COGNIS IP MANAGEMENT GMBH (DE) 2012-02-09 WO disclosed
WO-2012016642-A1 COSMETIC PREPARATIONS COGNIS IP MANAGEMENT GMBH (DE) 2012-02-09 WO disclosed
US-20100105903-A1 Method for the production of beta-ketonitriles BASF SE (DE) 2010-04-29 US disclosed
EP-2132167-A1 METHOD FOR THE PRODUCTION OF -KETONITRILES BASF SE (DE) 2009-12-16 EP disclosed
WO-2008107397-A1 METHOD FOR THE PRODUCTION OF β-KETONITRILES BASF SE (DE) 2008-09-12 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 (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-20130005970-A1 Method for the production of beta-ketonitriles AKR1C3, AKR1C4, AKR1C1 LMNA 262/4885CYP3A4 126/4885OPRM1 3316/4885
US-20100105903-A1 Method for the production of beta-ketonitriles AKR1C3, AKR1C4, AKR1C1 LMNA 262/4885CYP3A4 126/4885OPRM1 3316/4885
US-20120197025-A1 ORGANOPHOSPHORUS COMPOUNDS BASED ON TETRAPHENOL (TP)-SUBSTITUTED STRUCTURES PTMS, HPD, INPPL1 LMNA 2512/4885CYP3A4 532/4885OPRM1 1550/4885

“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.