SCHEMBL20438697

SCHEMBL20438697

CC(C)C(C)CN(CCOCCN(CC(C)C(C)C)CC(C)C(C)C)CC(C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PIK3CD O00329 1/20 0.33
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 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
SCHEMBL20445520 0.84 PIK3CD (0.33) PIK3CD
SCHEMBL20445521 0.83 PIK3CD (0.32) PIK3CD
SCHEMBL20438514 0.81
SCHEMBL21889830 0.77 BLM (0.39) BLMPMP22HSD17B10PIK3CDMEN1
SCHEMBL20438708 0.75 HSD17B10 (0.38) BLMPMP22HSD17B10MEN1POLB
SCHEMBL19542919 0.74
SCHEMBL20438562 0.74 CYP1A2 (0.39) PIK3CD
SCHEMBL14980564 0.73 HSD17B10 (0.41) BLMPMP22HSD17B10MEN1POLB
SCHEMBL19554740 0.72 ALDH1A1 (0.37) BLMPMP22HSD17B10PIK3CDMEN1
SCHEMBL20438513 0.72 OPRM1 (0.35) BLMPMP22HSD17B10PIK3CDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180214561-A1 EIGHT-ARM POLYETHYLENE GLYCOL DERIVATIVE, PRODUCTION METHOD THEREFOR, AND MODIFIEDBIO-RELATEDSUBSTANCETHEREOF XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2018-08-02 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 (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-20180214561-A1 EIGHT-ARM POLYETHYLENE GLYCOL DERIVATIVE, PRODUCTION METHOD THEREFOR, AND MODIFIEDBIO-RELATEDSUBSTANCETHEREOF MRPL38, CXCL8, ALG8 BLM 2838/4885PMP22 4170/4885HSD17B10 759/4885

“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.