SCHEMBL16624356

SCHEMBL16624356

Cc1cc(C)c(S(=O)(=O)Oc2nc(N)nc(C)c2Cc2ccc(OCCCO)cc2C)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 12/20 0.37
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DHFR P00374 1/20 0.34
PDIA6 Q15084 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
SLC5A1 P13866 2/20 0.32
SLC5A2 P31639 1/20 0.32
IKBKB O14920 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
SCHEMBL16617074 0.91 TLR7 (0.45) TLR7
SCHEMBL16624357 0.89 DHFR (0.33) TLR7MEN1LMNAMAPTKMT2A
SCHEMBL16624359 0.87 DHFR (0.34) TLR7MEN1LMNAMAPTKMT2A
SCHEMBL15305573 0.82 MEN1 (0.34) MEN1LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL16616829 0.81 TLR7 (0.39) TLR7
SCHEMBL16624353 0.79 TLR7 (0.44) TLR7
SCHEMBL4203291 0.79 TLR7 (0.39) TLR7MEN1LMNAMAPTKMT2A
SCHEMBL853422 0.79 TLR7 (0.38) TLR7DHFR
SCHEMBL16624354 0.78 TLR7 (0.41) TLR7MAPTKMT2ASMN1; SMN2DHFR
SCHEMBL6123086 0.77 TLR7 (0.45) TLR7

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 TLR7 87/4885MEN1 95/4885LMNA 2618/4885
US-20160251319-A1 CARBOXYLIC ACID COMPOUNDS C9, SUCNR1, C3AR1 TLR7 87/4885MEN1 95/4885LMNA 2618/4885

“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.