SCHEMBL2925440

SCHEMBL2925440

CCCCCCCCCCCCCCCCCCNC(=N)NCCCCCCCCCCCCCCCCCC

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
SCHEMBL10487390 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL1272676 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL10960416 1.00 EPHX1 (0.58) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL1273282 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1661586-B1 Disinfecting substrate BODE CHEMIE GMBH (DE) 2010-08-04 EP claimed
US-20060134056-A1 Use of alkylguanidines as cationic emulsifiers GOLDSCHMIDT AG (DE) 2006-06-22 US disclosed
EP-1671615-A2 Use of alkyl guanidines as cationic emulsifiers Goldschmidt GmbH (DE) 2006-06-21 EP disclosed
US-4497887-A Thermal development type diazo copying material with hydrophobic resin encapsulated coupler particle Ricoh Compay, Ltd. (JP) 1985-02-05 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-20060134056-A1 Use of alkylguanidines as cationic emulsifiers HBG2, GPR18, AAAS EPHX1 1839/4885CASP2 1701/4885ZDHHC20 960/4885

“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.