SCHEMBL309712

SCHEMBL309712

CCCCC(CCCCC(=O)OO)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLM Q9NP87 2/20 0.43
POLK Q9UBT6 2/20 0.43
POLL Q9UGP5 2/20 0.43
POLH Q9Y253 2/20 0.43
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 3/20 0.41
KDM4E B2RXH2 2/20 0.41
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
NFKB1 P19838 1/20 0.41
APEX1 P27695 1/20 0.41
MAPK1 P28482 1/20 0.41
PPARG P37231 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40

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
SCHEMBL6235686 0.81 ALDH1A1 (0.44) ALDH1A1HSD17B10KDM4ETP53GLA
SCHEMBL20469318 0.80 NR1H2 (0.49) ALDH1A1ASAH1GAA
SCHEMBL7520939 0.80 NR1H2 (0.40) ALDH1A1ASAH1LMNA
SCHEMBL21788258 0.79 NR1H2 (0.44) ALDH1A1KMT2AMEN1MAPTASAH1
SCHEMBL931966 0.79 TDP1 (0.48) ALDH1A1HSD17B10KDM4ETP53GLA
SCHEMBL14479254 0.77 TDP1 (0.44) ALDH1A1HSD17B10KDM4ETP53GLA
SCHEMBL1757645 0.77 ALDH1A1 (0.46) ALDH1A1HSD17B10KDM4ETP53GLA
SCHEMBL3195963 0.76 ALDH1A1 (0.48) ALDH1A1HSD17B10KDM4ETP53GLA
SCHEMBL8688322 0.76 DRD3 (0.47) ALDH1A1HSD17B10KDM4ETP53GLA
SCHEMBL29453019 0.76 ALDH1A1 (0.48) ALDH1A1HSD17B10KDM4ETP53GLA

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
US-8349781-B2 Fluid reservoir HENKEL AG & CO. KGAA (DE) 2013-01-08 US disclosed
US-20120093902-A1 FLUID RESERVOIR HENKEL AG & CO. KGAA (DE) 2012-04-19 US disclosed
US-20120077728-A1 FLUID RESERVOIR HENKEL AG & CO. KGAA (DE) 2012-03-29 US disclosed
US-8093197-B2 Fluid reservoir HENKEL AG & CO. KGAA (DE) 2012-01-10 US disclosed
US-7531498-B2 Peroxycarboxylic acid-based bleach compositions having a long shelf life HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2009-05-12 US disclosed
US-20090035337-A1 Fluid Reservoir HENKEL AG & CO. KGAA (DE) 2009-02-05 US disclosed
US-20060178285-A1 Peroxycaboxylic acid-based bleach compositions having a long shelf life HENKEL AG & CO. KGAA (DE) 2006-08-10 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 (3 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-20090035337-A1 Fluid Reservoir CD44, VCL, PEF1 POLM 1409/4885POLK 1449/4885POLL 1760/4885
US-20120077728-A1 FLUID RESERVOIR CD44, VCL, PEF1 POLM 1409/4885POLK 1449/4885POLL 1760/4885
US-20120093902-A1 FLUID RESERVOIR CD44, VCL, PEF1 POLM 1409/4885POLK 1449/4885POLL 1760/4885

“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.