SCHEMBL2293542

SCHEMBL2293542

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

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.33
TAAR1 Q96RJ0 3/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
DRD2 P14416 1/20 0.32
HTR2C P28335 1/20 0.32
CA12 O43570 4/20 0.31
CA1 P00915 4/20 0.31
CA9 Q16790 3/20 0.31
CA2 P00918 2/20 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
SCHEMBL8651182 0.83 HTR2A (0.46) HTR2ATAAR1MTNR1AMTNR1BDRD2
SCHEMBL2291101 0.83 HTR2A (0.36) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL2293537 0.76 HTR2A (0.34) HTR2ATAAR1HTR2CCA12CA1
SCHEMBL17184765 0.76 APLNR (0.36) HTR2ADRD2CA12CA1CA9
SCHEMBL2292629 0.76 CA12 (0.44) CA12CA1CA9
SCHEMBL9013390 0.76 CA12 (0.44) DRD2CA12CA1CA9
SCHEMBL2289303 0.74 THRA (0.40) HTR2ASMN1; SMN2
SCHEMBL23121794 0.73 HTR2A (0.40) HTR2ATAAR1DRD2HTR2C
SCHEMBL22323741 0.73 DRD2 (0.46) DRD2CA12CA1CA9CA2
SCHEMBL7240943 0.73 RIPK1 (0.36) TAAR1DRD2CA12CA1CA9

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 2679/4885MTNR1A 204/4885

“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.