SCHEMBL2719081

SCHEMBL2719081

COC(COc1ccc(C2CCC(c3ccc(OCC(OC)C4OC4C)cc3)CC2)cc1)C1OC1C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.36
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DRD2 P14416 1/20 0.35
HRH3 Q9Y5N1 5/20 0.34
SIGMAR1 Q99720 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KCNH2 Q12809 3/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34

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
SCHEMBL2718221 0.88 MCHR1 (0.38) MRGPRX4
SCHEMBL2825825 0.83 NPC1 (0.31) RAB9AMEN1KMT2A
SCHEMBL2720238 0.72 PPARD (0.34) MRGPRX4MEN1KMT2ACYP3A4CYP2C9
SCHEMBL2719431 0.71 RAB9A (0.35) MRGPRX4RAB9ADRD2HRH3KCNH2
SCHEMBL17614876 0.71 ESR2 (0.45) RAB9AHRH3SIGMAR1MEN1KMT2A
SCHEMBL11063160 0.69 ESR2 (0.46) RAB9AHRH3SIGMAR1MEN1KMT2A
SCHEMBL2133033 0.68 DRD2 (0.44) MRGPRX4RAB9ADRD2HRH3KCNH2
SCHEMBL9586183 0.67 NQO1 (0.61) RAB9ADRD2HRH3KCNH2CYP3A4
SCHEMBL2719083 0.67 RAB9A (0.41) RAB9ADRD2HRH3KCNH2CYP3A4
SCHEMBL12990842 0.65 ESR2 (0.53) RAB9ADRD2HRH3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1995245-B1 METHOD FOR PRODUCING EPOXY COMPOUND SUMITOMO CHEMICAL CO (JP) 2012-05-02 EP disclosed
EP-2133380-A1 RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed
US-20090054669-A1 Process For Producing Epoxy Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-02-26 US disclosed
US-20090018355-A1 Process for Crystallizing an Epoxy Compound SUMITOMO CHEMICAL COMPANY, LTD. 2009-01-15 US disclosed
EP-1995245-A1 METHOD FOR PRODUCING EPOXY COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-11-26 EP disclosed
EP-1995244-A1 METHOD FOR CRYSTALLIZATION OF EPOXY COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-11-26 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 (2 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-20090018355-A1 Process for Crystallizing an Epoxy Compound PTGER1, NR5A1, TCP1 MRGPRX4 1599/4885RAB9A 3113/4885L3MBTL1 4450/4885
US-20090054669-A1 Process For Producing Epoxy Compound RER1, AR, CYP1A1 MRGPRX4 1036/4885RAB9A 1772/4885L3MBTL1 4701/4885

“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.