SCHEMBL1201142

SCHEMBL1201142

NC(=O)CCC(NC(=O)C1CC1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
POLB P06746 1/20 0.44
CA2 P00918 5/20 0.43
CA1 P00915 4/20 0.43
FOLH1 Q04609 2/20 0.43
RIMKLA Q8IXN7 1/20 0.43
NAALAD2 Q9Y3Q0 1/20 0.43
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALOX15 P16050 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
MEN1 O00255 1/20 0.39
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38

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
SCHEMBL1201139 1.00 KMT2A (0.46) KMT2APOLBCA2CA1FOLH1
SCHEMBL5322259 0.92 KMT2A (0.43) KMT2APOLBCA2CA1FOLH1
SCHEMBL5322256 0.92 KMT2A (0.43) KMT2APOLBCA2CA1FOLH1
SCHEMBL24390546 0.87 KMT2A (0.46) KMT2APOLBCA2CA1FOLH1
SCHEMBL24390487 0.87 KMT2A (0.46) KMT2APOLBCA2CA1FOLH1
SCHEMBL21841510 0.83 CA2 (0.41) KMT2APOLBCA2CA1FOLH1
SCHEMBL16478816 0.81 FOLH1 (0.51) KMT2APOLBFOLH1MEN1
SCHEMBL9716584 0.79 FOLH1 (0.49) FOLH1LMNATDP1
SCHEMBL9716721 0.79 FOLH1 (0.49) FOLH1LMNATDP1
SCHEMBL9716589 0.79 FOLH1 (0.49) FOLH1LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7888351-B2 Organic compounds NOVARTIS AG (CH) 2011-02-15 US disclosed
US-20110034462-A1 ORGANIC COMPOUNDS BAESCHLIN DANIEL KASPAR 2011-02-10 US disclosed
US-20090281069-A1 ORGANIC COMPOUNDS BAESCHLIN DANIEL KASPAR 2009-11-12 US disclosed
EP-2007723-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2008-12-31 EP disclosed
WO-2007115821-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-10-18 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 (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-20090281069-A1 ORGANIC COMPOUNDS OTC, OAT, SLCO2B1 KMT2A 2877/4885POLB 933/4885CA2 621/4885
US-20110034462-A1 ORGANIC COMPOUNDS OTC, OAT, SLCO2B1 KMT2A 2877/4885POLB 933/4885CA2 621/4885

“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.