SCHEMBL1289417

SCHEMBL1289417

CCCC(=O)NCCCCCCCCCCC(=O)O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.74
EPHX2 P34913 5/20 0.68
ADRA1A P35348 1/20 0.62
PRMT1 Q99873 1/20 0.61
PLA2G2A P14555 1/20 0.61
NAAA Q02083 1/20 0.58
KDM4E B2RXH2 1/20 0.58
PLA2G4A P47712 1/20 0.56
PPARG P37231 5/20 0.56
PPARD Q03181 5/20 0.56
PPARA Q07869 5/20 0.56
HDAC11 Q96DB2 4/20 0.56
TSHR P16473 3/20 0.56
GPR84 Q9NQS5 3/20 0.56
ALDH1A1 P00352 2/20 0.56
TLR2 O60603 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
FABP4 P15090 2/20 0.56
PTPN1 P18031 2/20 0.56
SLC22A6 Q4U2R8 1/20 0.56

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
SCHEMBL9262199 1.00 CASP2 (0.74) CASP2EPHX2ADRA1APRMT1PLA2G2A
SCHEMBL9830734 1.00 CASP2 (0.74) CASP2EPHX2ADRA1APRMT1PLA2G2A
SCHEMBL9830305 0.98 CASP2 (0.70) CASP2EPHX2ADRA1APRMT1PLA2G2A
Myristic Acid SCHEMBL20893594 0.96 CASP2 (0.81) CASP2EPHX2PLA2G2ANAAAKDM4E
SCHEMBL7749788 0.92 CASP2 (0.67) CASP2EPHX2ADRA1APRMT1PLA2G2A
SCHEMBL23052005 0.90 EPHX2 (0.81) CASP2EPHX2PLA2G2ANAAAKDM4E
SCHEMBL20844943 0.90 EPHX2 (0.76) CASP2EPHX2ADRA1APLA2G2ANAAA
SCHEMBL22072061 0.90 EPHX2 (0.81) CASP2EPHX2PLA2G2ANAAAKDM4E
SCHEMBL22684645 0.90 EPHX2 (0.81) CASP2EPHX2PLA2G2ANAAAKDM4E
SCHEMBL8041499 0.90 EPHX2 (0.81) CASP2EPHX2PLA2G2ANAAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9708521-B2 Systems and methods employing low molecular weight gelators for crude oil, petroleum product or chemical spill containment and remediation GEORGETOWN UNIVERSITY (US) 2017-07-18 US disclosed
US-9109150-B2 Fast recovery of thixotropy by organogels with low molecular weight gelators GEORGETOWN UNIVERSITY (US) 2015-08-18 US disclosed
EP-2609066-A1 LOW MOLECULAR WEIGHT GELATORS FOR CRUDE OIL, PETROLEUM PRODUCT OR CHEMICAL SPILL CONTAINMENT Georgetown University (US) 2013-07-03 EP disclosed
US-20120136074-A1 SYSTEMS AND METHODS EMPLOYING LOW MOLECULAR WEIGHT GELATORS FOR CRUDE OIL, PETROLEUM PRODUCT OR CHEMICAL SPILL CONTAINMENT AND REMEDIATION GEORGETOWN UNIVERSITY (US) 2012-05-31 US disclosed
WO-2012047251-A1 LOW MOLECULAR WEIGHT GELATORS FOR CRUDE OIL, PETROLEUM PRODUCT OR CHEMICAL SPILL CONTAINMENT GEORGETOWN UNIVERSITY (US) 2012-04-12 WO disclosed
US-20110251294-A1 FAST RECOVERY OF THIXOTROPY BY ORGANOGELS WITH LOW MOLECULAR WEIGHT GELATORS GEORGETOWN UNIVERSITY (US) 2011-10-13 US disclosed
US-7459014-B2 Radiation curable inks containing curable gelator additives XEROX CORPORATION (US) 2008-12-02 US disclosed
US-7459014-B2 Radiation curable inks containing curable gelator additives XEROX CORPORATION (US) 2008-12-02 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 (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-20110251294-A1 FAST RECOVERY OF THIXOTROPY BY ORGANOGELS WITH LOW MOLECULAR WEIGHT GELATORS TBXAS1, TBXA2R, TSNAX CASP2 4496/4885EPHX2 414/4885ADRA1A 246/4885

“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.