SCHEMBL19251341

SCHEMBL19251341

COCc1cccc(N2CCCC2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGXT P21549 3/20 0.71
PRMT6 Q96LA8 1/20 0.59
L3MBTL3 Q96JM7 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MBTD1 Q05BQ5 1/20 0.46
TP53BP1 Q12888 1/20 0.46
HCRTR1 O43613 7/20 0.45
HCRTR2 O43614 7/20 0.45
CHKA P35790 2/20 0.44
CACNA2D1 P54289 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 2/20 0.44
SLC6A2 P23975 1/20 0.44
GAA P10253 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 2/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL14288609 0.85 AGXT (0.73) AGXTPRMT6HCRTR1HCRTR2
SCHEMBL13451177 0.85 ADRB1 (0.62) AGXTALDH1A1
SCHEMBL19240350 0.82 AGXT (0.65) AGXTPRMT6L3MBTL3L3MBTL1MBTD1
SCHEMBL166575 0.80 PRMT6 (0.65) AGXTPRMT6L3MBTL3L3MBTL1MBTD1
SCHEMBL18933602 0.79 AGXT (0.46) AGXTPRMT6CACNA2D1SLC6A2MAPT
SCHEMBL4480384 0.79 PRMT6 (0.68) AGXTPRMT6L3MBTL3L3MBTL1MBTD1
SCHEMBL22516758 0.78 AGXT (0.46) AGXTPRMT6L3MBTL3L3MBTL1MBTD1
SCHEMBL195501 0.77 AGXT (0.62) AGXTPRMT6L3MBTL3L3MBTL1MBTD1
SCHEMBL10244433 0.77 PRMT6 (0.61) AGXTPRMT6L3MBTL3L3MBTL1MBTD1
SCHEMBL19604155 0.77 PRMT6 (0.60) AGXTPRMT6L3MBTL3L3MBTL1MBTD1

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-20170233352-A1 HSP70 MODULATORS AND METHODS FOR MAKING AND USING THE SAME MEMORIAL SLOAN KETTERING CANCER CENTER 2017-08-17 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-20170233352-A1 HSP70 MODULATORS AND METHODS FOR MAKING AND USING THE SAME HSPA2, HSP90AA1, HSP90AB1 AGXT 3264/4885PRMT6 1134/4885L3MBTL3 654/4885

“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.