SCHEMBL16941024

SCHEMBL16941024

CCC(CC(C)C(=O)NCCN)C(=O)NCCOC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.46
TSHR P16473 1/20 0.46
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
POLB P06746 1/20 0.36
HPGD P15428 2/20 0.36
RXFP1 Q9HBX9 2/20 0.36
DDAH1 O94760 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
REN P00797 3/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.33
CYP2C19 P33261 1/20 0.33
DPP7 Q9UHL4 1/20 0.33

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
SCHEMBL16941021 0.92 MEN1 (0.46) USP2TSHRMEN1KMT2APOLB
SCHEMBL16941025 0.81 MEN1 (0.43) USP2TSHRMEN1KMT2ACA1
SCHEMBL17358795 0.80 USP2 (0.55) USP2TSHRCA1CA2CA7
SCHEMBL9965936 0.80 USP2 (0.48) USP2TSHRMEN1KMT2APOLB
SCHEMBL21401134 0.79 MEN1 (0.44) USP2TSHRMEN1KMT2APOLB
SCHEMBL11810200 0.78 TSHR (0.74) USP2TSHRKMT2ACA1CA2
SCHEMBL16941026 0.76 TSHR (0.38) USP2TSHRMEN1KMT2APOLB
SCHEMBL19841540 0.75 DDAH1 (0.46) MEN1KMT2APOLBHPGDDDAH1
SCHEMBL16941017 0.74 MEN1 (0.40) USP2TSHRMEN1KMT2ACA1
SCHEMBL25875124 0.74 MEN1 (0.43) USP2TSHRMEN1KMT2ACA2

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-9795689-B2 Crosslinked polymer nano-assemblies and uses thereof UNIVERSITY OF MASSACHUSETTS (US) 2017-10-24 US disclosed
US-20150209447-A1 CROSSLINKED POLYMER NANO-ASSEMBLIES AND USES THEREOF UNIVERSITY OF MASSACHUSETTS (US) 2015-07-30 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-20150209447-A1 CROSSLINKED POLYMER NANO-ASSEMBLIES AND USES THEREOF MSN, PARG, PARN USP2 242/4885TSHR 4491/4885MEN1 1955/4885

“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.