SCHEMBL2293537

SCHEMBL2293537

CC[Si](CC)(CC)Oc1cc(Br)c(CBr)cc1O[Si](CC)(CC)CC

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 9/20 0.34
TAAR1 Q96RJ0 3/20 0.34
HTR2C P28335 1/20 0.33
CA1 P00915 4/20 0.32
CA2 P00918 4/20 0.32
CA9 Q16790 3/20 0.32
CA12 O43570 3/20 0.32
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL2291101 0.81 HTR2A (0.36) HTR2ATAAR1HTR2CCA1CA2
SCHEMBL2293542 0.76 HTR2A (0.33) HTR2ATAAR1HTR2CCA1CA2
SCHEMBL2292173 0.75
SCHEMBL2294326 0.74 HTR2A (0.52) HTR2ATAAR1HTR2CCA1CA2
SCHEMBL29758521 0.74 HTR2A (0.52) HTR2ATAAR1HTR2CCA1CA2
SCHEMBL2295493 0.73 THRA (0.36) HTR2AKMT2ASMN1; SMN2
SCHEMBL14462432 0.69
SCHEMBL2293507 0.68 HTR2A (0.37) HTR2ATAAR1HTR2CCA1CA2
SCHEMBL2268703 0.67 ALOX15 (0.37) CA1CA2
SCHEMBL2288266 0.67 TNFSF11 (0.42) CA1CA2CA9CA12

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 HTR2A 667/4885TAAR1 2679/4885HTR2C 426/4885

“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.