SCHEMBL16624352

SCHEMBL16624352

Cc1cc(OCCCO[Si](C)(C)C(C)(C)C)ccc1Cc1c(C)nc(N)nc1O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DHFR P00374 4/20 0.39
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
TLR7 Q9NYK1 3/20 0.33
SLC5A1 P13866 1/20 0.33
SLC2A1 P11166 1/20 0.32

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
SCHEMBL3705863 0.89 TLR7 (0.43) DHFRTLR7
SCHEMBL16624354 0.84 TLR7 (0.41) DHFRALDH1A1MAPTKMT2ATLR7
SCHEMBL16624328 0.81 NPSR1 (0.37) DHFRALDH1A1MAPTKMT2ATLR7
SCHEMBL16624326 0.81 KMT2A (0.44) DHFRALDH1A1MAPTKMT2ATLR7
SCHEMBL16624359 0.80 DHFR (0.34) DHFRMAPTKMT2ATLR7SLC5A1
SCHEMBL16624350 0.80 TLR7 (0.58) TLR7
SCHEMBL16624378 0.77 TLR7 (0.50) TLR7
SCHEMBL3705700 0.77 TLR7 (0.47) TLR7
SCHEMBL16624370 0.77 PDIA6 (0.38) MAPTKMT2ASLC5A1
SCHEMBL16624376 0.74 PDIA6 (0.38) MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160251319-A1 CARBOXYLIC ACID COMPOUNDS SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2016-09-01 US disclosed
US-9376398-B2 Carboxylic acid compounds SUMITOMO DAINIPPON PHARMA CO., LTD (JP) 2016-06-28 US disclosed
US-20150099770-A1 CARBOXYLIC ACID COMPOUNDS Sumitomo Pharma Co., Ltd. (JP) 2015-04-09 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 (2 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-20150099770-A1 CARBOXYLIC ACID COMPOUNDS C9, SUCNR1, C3AR1 DHFR 1267/4885ALDH1A1 68/4885MAPT 4427/4885
US-20160251319-A1 CARBOXYLIC ACID COMPOUNDS C9, SUCNR1, C3AR1 DHFR 1267/4885ALDH1A1 68/4885MAPT 4427/4885

“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.