SCHEMBL2295286

SCHEMBL2295286

COc1cc(C=O)c(COc2c(C)cccc2C)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.46
MAPT P10636 7/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 2/20 0.45
TSHR P16473 1/20 0.45
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
HPGD P15428 1/20 0.44
SCN8A Q9UQD0 1/20 0.42
PRKDC P78527 2/20 0.41
HTT P42858 2/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
CYP1A2 P05177 1/20 0.41
HTR1A P08908 1/20 0.40
ADRA1D P25100 1/20 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
SCHEMBL2290946 0.85 CDK4 (0.39) ALDH1A1MAPTSMN1; SMN2MEN1POLB
SCHEMBL2289128 0.85 ALDH1A1 (0.37) ALDH1A1MAPTSMN1; SMN2MEN1POLB
SCHEMBL2292761 0.84 PTPN1 (0.48) ALDH1A1MAPTSMN1; SMN2MEN1POLB
SCHEMBL2286452 0.83 ALDH1A1 (0.36) ALDH1A1MAPTSMN1; SMN2MEN1POLB
Benzene SCHEMBL2293259 0.83 PTPN1 (0.47) ALDH1A1MAPTSMN1; SMN2MEN1POLB
SCHEMBL2293617 0.82 TRIM24 (0.49) ALDH1A1MAPTSMN1; SMN2MEN1POLB
SCHEMBL2293035 0.81 CDK4 (0.36) ALDH1A1MAPTSMN1; SMN2MEN1POLB
SCHEMBL2289840 0.80 FFAR1 (0.35) ALDH1A1MAPTSMN1; SMN2MEN1POLB
SCHEMBL2290423 0.80 KMT2A (0.39) ALDH1A1MAPTSMN1; SMN2MEN1POLB
SCHEMBL2292560 0.79 LMNA (0.41) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A

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 ALDH1A1 83/4885MAPT 3284/4885SMN1; SMN2 3093/4885

“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.