SCHEMBL18237477

SCHEMBL18237477

CC(C)n1nnc2c1C(=O)CCC2

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
CYP1A2 P05177 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP2C19 P33261 1/20 0.37
TSHR P16473 1/20 0.33
CYP11B2 P19099 5/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 1/20 0.31
ABCG2 Q9UNQ0 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
SCHEMBL19152726 0.76 PLK1 (0.38) TOP2AALDH1A1TSHRCYP11B2CSNK2A1
SCHEMBL19130953 0.72 TOP2A (0.36) TOP2ASMN1; SMN2CYP1A2ALDH1A1CYP2C19
SCHEMBL19131907 0.71 CSNK2A1 (0.39) TOP2ASMN1; SMN2CYP1A2ALDH1A1CYP2C19
SCHEMBL22413687 0.69 GRM5 (0.35) SMN1; SMN2CYP1A2ALDH1A1CYP2C19
SCHEMBL19131077 0.69 TOP2A (0.40) TOP2ASMN1; SMN2CYP1A2ALDH1A1CYP2C19
SCHEMBL16577949 0.68 GRM5 (0.34)
SCHEMBL18237933 0.68
SCHEMBL22612201 0.67 CSNK2A2 (0.36) SMN1; SMN2CYP1A2ALDH1A1TSHRCYP11B2
SCHEMBL21670417 0.67 CYP11B2 (0.48) CYP11B2
SCHEMBL18237478 0.67 CRBN (0.33) TOP2ASMN1; SMN2CYP1A2ALDH1A1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230000993-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO INC (US) 2023-01-05 US disclosed
US-9931407-B2 Silicon based drug conjugates and methods of using same BLINKBIO, INC. (US) 2018-04-03 US disclosed
US-9931407-B2 Silicon based drug conjugates and methods of using same BLINKBIO, INC. (US) 2018-04-03 US disclosed
US-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 US disclosed
US-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 US disclosed
WO-2016183359-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. (US) 2016-11-17 WO 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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT TOP2A 109/4885SMN1; SMN2 506/4885CYP1A2 3086/4885
US-20230000993-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT TOP2A 109/4885SMN1; SMN2 506/4885CYP1A2 3086/4885

“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.