SCHEMBL18237698

SCHEMBL18237698

CC(C)c1nccc2[nH]c(=O)ncc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 12/20 0.44
PDE3A Q14432 12/20 0.44
PARP1 P09874 1/20 0.36
CAPN1 P07384 1/20 0.34
AURKA O14965 1/20 0.34
DAPK3 O43293 1/20 0.34
JAK2 O60674 1/20 0.34
MAP4K4 O95819 1/20 0.34
PAK4 O96013 1/20 0.34
ABL1 P00519 1/20 0.34
LCK P06239 1/20 0.34
FYN P06241 1/20 0.34
CSF1R P07333 1/20 0.34
RET P07949 1/20 0.34
IGF1R P08069 1/20 0.34
FLT1 P17948 1/20 0.34
LTK P29376 1/20 0.34
KDR P35968 1/20 0.34
FLT3 P36888 1/20 0.34
MAPK8 P45983 1/20 0.34

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
SCHEMBL10810836 0.78 PDE3B (0.71) PDE3BPDE3AAURKADAPK3JAK2
SCHEMBL19153110 0.77 PDE3B (0.61) PDE3BPDE3A
SCHEMBL19131362 0.75 CAPN1 (0.35) PDE3BPDE3ACAPN1GSK3B
SCHEMBL16339751 0.74 IDO1 (0.41) JAK2FLT3TLR9TLR8TLR7
SCHEMBL26875018 0.73 PDE10A (0.37)
SCHEMBL18237425 0.70 PDE3B (0.40) PDE3BPDE3ACAPN1AURKADAPK3
SCHEMBL28022676 0.69 ALDH1A1 (0.53) PARP1
SCHEMBL10316409 0.69 UTS2R (0.39) PDE3BPDE3AAURKADAPK3JAK2
SCHEMBL4546566 0.68 TRPA1 (0.41) PDE3BPDE3AAURKAAURKB
SCHEMBL2733976 0.68 TDO2 (0.65) CDK5DYRK1A

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 2 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
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 (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-20230000993-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT PDE3B 4693/4885PDE3A 4572/4885PARP1 2195/4885

“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.