SCHEMBL4187679

SCHEMBL4187679

C=CCC1=C(O)CCC1=O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL4396504 0.74 NPSR1 (0.30)
SCHEMBL19306392 0.71 MEN1 (0.32) MEN1LMNAKMT2A
SCHEMBL7121422 0.70
SCHEMBL11135809 0.70
SCHEMBL11833680 0.69 CYP19A1 (0.34) MEN1KMT2AALDH1A1
SCHEMBL7568134 0.68 MEN1 (0.35) MEN1LMNAKMT2A
SCHEMBL11881419 0.67 MEN1 (0.34) MEN1LMNAKMT2A
SCHEMBL11287722 0.66 TOP1 (0.46) MEN1LMNAKMT2AALDH1A1POLB
SCHEMBL11287720 0.66 TOP1 (0.46) MEN1LMNAKMT2AALDH1A1POLB
SCHEMBL10573499 0.65 MEN1 (0.30) MEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63083040-A None JP disclosed
EP-2046147-B1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2013-05-01 EP disclosed
US-20090311403-A1 Method of Using Organic Compounds GIVAUDAN SA (CH) 2009-12-17 US disclosed
CN-101494999-A Method for using organic compound GIVAUDAN SA (CH) 2009-07-29 CN disclosed
EP-2046147-A1 METHOD OF USING ORGANIC COMPOUNDS Givaudan SA (CH) 2009-04-15 EP disclosed
WO-2008011742-A1 METHOD OF USING ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2008-01-31 WO disclosed
JP-S6383040-A PRODUCTION OF HYDROXYALKYLCYCLOPENTENONE DERIVATIVE SUMITOMO CHEM CO LTD 1988-04-13 JP 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-20090311403-A1 Method of Using Organic Compounds MGLL, GK, LIPC MEN1 1073/4885LMNA 1235/4885KMT2A 3062/4885

“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.