SCHEMBL4331840

SCHEMBL4331840

CCOP(=O)(OCC)C(C(=O)OC)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.59
KMT2A Q03164 2/20 0.50
MAPT P10636 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPK1 P28482 1/20 0.46
GAA P10253 1/20 0.45

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
SCHEMBL8555215 0.89 POLB (0.61) POLBKMT2AMAPTSMN1; SMN2MEN1
SCHEMBL27946037 0.86 POLB (0.58) POLBKMT2AMAPTSMN1; SMN2MEN1
SCHEMBL7261188 0.85 POLB (0.65) POLBKMT2AMAPTSMN1; SMN2MEN1
SCHEMBL7260513 0.83 POLB (0.61) POLBKMT2AMAPTSMN1; SMN2MEN1
SCHEMBL1413618 0.78 KMT2A (0.58) KMT2AMEN1KDM4ELMNAALDH1A1
SCHEMBL7256728 0.78 POLB (0.55) POLBKMT2AMAPTSMN1; SMN2MEN1
SCHEMBL20346311 0.76 MAPT (0.48) POLBKMT2AMAPTSMN1; SMN2MEN1
SCHEMBL6756690 0.75 POLB (1.00) POLBMAPTKDM4ELMNAALDH1A1
SCHEMBL31232896 0.75 POLB (1.00) POLBMAPTKDM4ELMNAALDH1A1
SCHEMBL7160912 0.74 POLB (0.68) POLBKMT2AMAPTSMN1; SMN2MEN1

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
US-20090215795-A1 CYCLIC AMIDINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-08-27 US disclosed
EP-1386912-B1 CYCLIC AMIDINE DERIVATIVE EISAI R&D MAN CO LTD (JP) 2009-03-18 EP disclosed
US-7476688-B2 Cyclic amidine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-01-13 US disclosed
US-20040254376-A1 Cyclic amidine derivative EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-12-16 US disclosed
EP-1386912-A1 CYCLIC AMIDINE DERIVATIVE Eisai Co., Ltd. (JP) 2004-02-04 EP disclosed
US-4233440-A OPTICAL BRIGHTENERS BAYER AKTIENGESELLSCHAFT (DE) 1980-11-11 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 (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-20040254376-A1 Cyclic amidine derivative ARGLU1, ARG1, PRMT1 POLB 4577/4885KMT2A 1267/4885MAPT 4592/4885
US-20090215795-A1 CYCLIC AMIDINE DERIVATIVES H1-10, H1-3, H1-4 POLB 4743/4885KMT2A 2585/4885MAPT 4417/4885

“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.