SCHEMBL2290957

SCHEMBL2290957

CCOCc1ccc(C=O)c(COc2c(C)cccc2C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 2/20 0.35
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
GAA P10253 1/20 0.34
PTGER4 P35408 4/20 0.34
PTGER3 P43115 4/20 0.34
PTGER2 P43116 4/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTT P42858 2/20 0.34
PTGER1 P34995 3/20 0.33
CDK4 P11802 2/20 0.33
CCND1 P24385 2/20 0.33
CCNB2 O95067 1/20 0.33

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
SCHEMBL1201073 0.87 ERN1 (0.41) SCN8AALDH1A1KMT2AMAPTMEN1
SCHEMBL7672436 0.83 ALDH1A1 (0.36) ALDH1A1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL2292586 0.82 BCHE (0.38) SCN8AALDH1A1KMT2AMAPTMEN1
SCHEMBL1201226 0.82 ALDH1A1 (0.36) SCN8AALDH1A1KMT2AMAPTMEN1
SCHEMBL2289742 0.82 TSHR (0.39) SCN8AALDH1A1KMT2AMAPTMEN1
SCHEMBL2289750 0.82 CCNB2 (0.40) ALDH1A1KMT2AMAPTMEN1POLB
SCHEMBL2290297 0.81 THRA (0.40) SCN8AALDH1A1KMT2AMAPTPOLB
SCHEMBL2288687 0.81 SCN8A (0.36) SCN8AALDH1A1KMT2AMAPTMEN1
SCHEMBL2293213 0.79 SCN4A (0.35) SCN8AALDH1A1KMT2AMAPTMEN1
SCHEMBL1200920 0.78 ALDH1A1 (0.42) SCN8AALDH1A1KMT2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2149545-B1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2016-10-05 EP disclosed
US-7994367-B2 Method for producing benzaldehyde compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-09 US disclosed
US-20100210879-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-19 US disclosed
EP-2149545-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-02-03 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 (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-20100210879-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND NQO1, C9, TRPA1 SCN8A 1991/4885ALDH1A1 83/4885KMT2A 481/4885

“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.