SCHEMBL5980955

SCHEMBL5980955

O=C(OCc1ccccc1)C(O)(CC1CCCCCC1)C1CCCCO1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
EPHX1 P07099 1/20 0.38
CYP1A2 P05177 1/20 0.38
PREP P48147 1/20 0.37
CASP1 P29466 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
SCHEMBL8018444 0.82 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ANPSR1EPHX1
SCHEMBL8028322 0.81 MEN1 (0.41) ALDH1A1MEN1KMT2ANPSR1CYP1A2
SCHEMBL15106304 0.80 CYP1A2 (0.43) ALDH1A1MEN1KMT2ANPSR1CYP1A2
SCHEMBL27538081 0.73 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AEPHX1CASP1
SCHEMBL7299993 0.71 NPC1 (0.42) ALDH1A1MEN1KMT2AEPHX1CASP1
SCHEMBL16370006 0.71 ALDH1A1 (0.49) ALDH1A1MEN1KMT2A
SCHEMBL16407804 0.71 ALDH1A1 (0.49) ALDH1A1MEN1KMT2A
SCHEMBL21886493 0.70 ALDH1A1 (0.52) ALDH1A1CYP1A2
SCHEMBL26048629 0.70 ALDH1A1 (0.52) ALDH1A1CYP1A2
SCHEMBL16362626 0.69 CHRM3 (0.45) ALDH1A1MEN1KMT2AEPHX1

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-1425009-A4 PEPTIDE ARGINALS AND METHODS FOR TREATING DISSEMINATED INTRAVASCULAR COAGULATION IVAX INST FOR DRUG RES LTD (HU) 2006-10-25 EP disclosed
US-20050070480-A1 Peptide arginals and methods for treating disseminated intravascular coagulation IVAX DRUG RESEARCH INSTITUTE LTD. (HU) 2005-03-31 US disclosed
EP-1425009-A2 PEPTIDE ARGINALS AND METHODS FOR TREATING DISSEMINATED INTRAVASCULAR COAGULATION Ivax Institute for Drug Research, Ltd. (HU) 2004-06-09 EP disclosed
WO-2003016273-A2 PEPTIDE ARGINALS AND METHODS FOR TREATING DISSEMINATED INTRAVASCULAR COAGULATION IVAX CORPORATION (US) 2003-02-27 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-20050070480-A1 Peptide arginals and methods for treating disseminated intravascular coagulation ARGLU1, PLAT, SERPINC1 ALDH1A1 4482/4885MEN1 1449/4885KMT2A 3538/4885

“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.