SCHEMBL1273282

SCHEMBL1273282

CCCCCCCCCCCCNC(=N)NCCCCCCCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 11/20 0.58
CASP2 P42575 1/20 0.52
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
NAAA Q02083 1/20 0.48
SPHK1 Q9NYA1 3/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
FAAH O00519 1/20 0.44

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
SCHEMBL1273739 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL10960588 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL10961098 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL1273855 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL10962041 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL22622093 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL2925440 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL10487390 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL1272676 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL10960416 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10077336-B2 Functionalized highly branched melamine-polyamine polymers BASF SE (DE) 2018-09-18 US disclosed
EP-2545123-B1 POLYAMIDES RESISTANT TO HOT AGEING BASF SE (DE) 2018-05-16 EP disclosed
US-8466221-B2 Polyamides that resist heat-aging BASF SE (DE) 2013-06-18 US disclosed
EP-2545123-A1 POLYAMIDES RESISTANT TO HOT AGEING BASF SE (DE) 2013-01-16 EP disclosed
EP-2513201-A1 FUNCTIONALIZED HIGHLY BRANCHED MELAMINE-POLYAMINE POLYMERS BASF SE (DE) 2012-10-24 EP disclosed
US-20120252987-A1 FUNCTIONALIZED HIGHLY BRANCHED MELAMINE-POLYAMINE POLYMERS BASF SE (DE) 2012-10-04 US disclosed
WO-2011128437-A1 HIGHLY BRANCHED AMINE POLYMERS AND AMINE OLIGOMERS AS CORROSION INHIBITOR BASF SE (DE) 2011-10-20 WO disclosed
US-20110257321-A1 HIGHLY BRANCHED POLYAMINES AND OLIGOAMINES AS CORROSION INHIBITORS BASF SE (DE) 2011-10-20 US disclosed
US-20110224347-A1 POLYAMIDES THAT RESIST HEAT-AGING BASF SE (DE) 2011-09-15 US disclosed
WO-2011110508-A1 POLYAMIDES RESISTANT TO HOT AGEING BASF SE (DE) 2011-09-15 WO disclosed
EP-2285861-A2 HYPERBRANCHED POLYMERS AND OLIGOMERS COMPRISING TERMINAL AMINO GROUPS AS CURING AGENTS FOR EPOXY RESINS BASF SE (DE) 2011-02-23 EP disclosed
US-20110028603-A1 HYPERBRANCHED POLYMERS AND OLIGOMERS COMPRISING TERMINAL AMINO GROUPS AS CURING AGENTS FOR EPOXY RESINS BASF SE (DE) 2011-02-03 US disclosed
WO-2009124998-A2 HYPERBRANCHED POLYMERS AND OLIGOMERS COMPRISING TERMINAL AMINO GROUPS AS CURING AGENTS FOR EPOXY RESINS BASF SE (DE) 2009-10-15 WO disclosed
US-20090194124-A1 Hair Shaping Kit and Process Comprising at Least One Non-Hydroxide Imine MALLE GERARD 2009-08-06 US disclosed
WO-2009080787-A1 HYPERBRANCHED UREA-MELAMINE POLYMERS BASF SE (DE) 2009-07-02 WO disclosed
US-20090139537-A1 HAIR RELAXING COMPOSITION COMPRISING AT LEAST ONE NON-HYDROXIDE IMINE L'OREAL S.A. 2009-06-04 US disclosed
US-20050136017-A1 Cosmetic containing an imine reactive with the cystines of keratin fibers via a beta-elimination reaction to produce dehydroalanine and lead to formation of lanthionine in a medium free of polyhydroxylated alkane; guanidine and/or amidine imines such as dimethylguanidine; noncaustic for use on hair, skin L'OREAL S.A. (FR) 2005-06-23 US disclosed
US-20050129645-A1 Hair shaping composition comprising at least one non-hydroxide imine L'OREAL 2005-06-16 US disclosed
EP-1532963-A1 Composition for straightening the hair comprising at least one imine not being an hydroxide L'OREAL (FR) 2005-05-25 EP disclosed
EP-1532960-A1 Hair styling composition containing a non-hydroxide imine L'OREAL (FR) 2005-05-25 EP 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 (5 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-20120252987-A1 FUNCTIONALIZED HIGHLY BRANCHED MELAMINE-POLYAMINE POLYMERS PARN, INMT, SRM EPHX1 4217/4885CASP2 4594/4885ZDHHC20 1866/4885
US-20090139537-A1 HAIR RELAXING COMPOSITION COMPRISING AT LEAST ONE NON-HYDROXIDE IMINE KRT18, INMT, INHA EPHX1 3319/4885CASP2 4367/4885ZDHHC20 1830/4885
US-20090194124-A1 Hair Shaping Kit and Process Comprising at Least One Non-Hydroxide Imine KRT18, KIT, PRDM7 EPHX1 2311/4885CASP2 3271/4885ZDHHC20 2410/4885
US-20050129645-A1 Hair shaping composition comprising at least one non-hydroxide imine KRT18, INHA, H1-5 EPHX1 2359/4885CASP2 4409/4885ZDHHC20 1334/4885
US-20050136017-A1 Cosmetic containing an imine reactive with the cystines of keratin fibers via a beta-elimination reaction to produce dehydroalanine and lead to formation of lanthionine in a medium free of polyhydroxylated alkane; guanidine and/or amidine imines such as dimethylguanidine; noncaustic for use on hair, skin BHMT, KRT18, INMT EPHX1 3675/4885CASP2 4303/4885ZDHHC20 1614/4885

“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.