SCHEMBL16640292

SCHEMBL16640292

O=C1NC(=O)C(C2CCCCCCCCCC2)N1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
TSHR P16473 2/20 0.38
BACE1 P56817 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 1/20 0.33
CASP1 P29466 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RGS12 O14924 1/20 0.31
CTSD P07339 1/20 0.30
PRCP P42785 1/20 0.30

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
SCHEMBL7061475 1.00 MAPT (0.44) MAPTTSHRBACE1TDP1ALDH1A1
SCHEMBL9402183 1.00 MAPT (0.44) MAPTTSHRBACE1TDP1ALDH1A1
SCHEMBL9402140 0.98 MAPT (0.41) MAPTTSHRBACE1TDP1ALDH1A1
SCHEMBL7539674 0.89 TSHR (0.42) MAPTTSHRBACE1TDP1ALDH1A1
SCHEMBL2755248 0.81 TSHR (0.37) MAPTTSHRBACE1TDP1
SCHEMBL3168007 0.79 TSHR (0.35) TSHRBACE1TDP1
SCHEMBL11021416 0.79 TSHR (0.32) MAPTTSHRBACE1RGS12
SCHEMBL24001183 0.76 TSHR (0.38) TSHRBACE1TDP1
SCHEMBL14354358 0.75 TSHR (0.52) MAPTTSHRBACE1TDP1ALDH1A1
SCHEMBL13163013 0.75 PLG (0.37) TSHRBACE1RGS12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190352288-A1 MATRIX METALLOPROTEINASE (MMP) INHIBITORS AND METHODS OF USE THEREOF FORESEE PHARMACEUTICALS CO., LTD (TW) 2019-11-21 US disclosed
US-9469637-B2 Nitrogenated heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-10-18 US disclosed
US-20150105373-A1 NITROGENATED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-16 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 (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-20150105373-A1 NITROGENATED HETEROCYCLIC COMPOUND PDE2A, PDE5A, PDE3A MAPT 487/4885TSHR 3276/4885BACE1 36/4885
US-20190352288-A1 MATRIX METALLOPROTEINASE (MMP) INHIBITORS AND METHODS OF USE THEREOF MMP12, MMP1, MMP11 MAPT 3677/4885TSHR 4265/4885BACE1 605/4885

“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.