SCHEMBL6789108

SCHEMBL6789108

CCN(CC)c1ccc(C=C2N=C(c3ccccc3Cl)OC2=O)cc1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
MEN1 O00255 5/20 0.50
MAPT P10636 4/20 0.50
TNNI3 P19429 2/20 0.50
TNNT2 P45379 2/20 0.50
TNNC1 P63316 2/20 0.50
DAPK3 O43293 1/20 0.47
MASP2 O00187 1/20 0.46
NOTUM Q6P988 3/20 0.45
ALDH1A1 P00352 5/20 0.44
ALOX5 P09917 1/20 0.44
F2 P00734 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 2/20 0.43
HPGD P15428 2/20 0.41
POLB P06746 1/20 0.41
GFER P55789 1/20 0.41

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
SCHEMBL6789103 1.00 KMT2A (0.50) KMT2AMEN1MAPTTNNI3TNNT2
SCHEMBL6790252 0.83 PLCG2 (0.60) KMT2AMEN1MAPTDAPK3NOTUM
SCHEMBL6790249 0.83 PLCG2 (0.60) KMT2AMEN1MAPTDAPK3NOTUM
SCHEMBL3585803 0.82 DAPK3 (0.57) KMT2AMAPTDAPK3MASP2NOTUM
SCHEMBL3585256 0.82 DAPK3 (0.57) KMT2AMAPTDAPK3MASP2NOTUM
SCHEMBL3585257 0.82 DAPK3 (0.57) KMT2AMAPTDAPK3MASP2NOTUM
SCHEMBL6796514 0.79 MAPK1 (0.58) KMT2AMEN1MAPTDAPK3NOTUM
SCHEMBL6796512 0.79 MAPK1 (0.58) KMT2AMEN1MAPTDAPK3NOTUM
SCHEMBL6797903 0.78 ALDH1A1 (0.53) KMT2AMEN1MAPTDAPK3NOTUM
SCHEMBL6797901 0.78 ALDH1A1 (0.53) KMT2AMEN1MAPTDAPK3NOTUM

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-20040180943-A1 Oxazolone analogs as amyloid aggregation inhibitors and for the treatment of alzheimer's disease and disorders related to amyloidosis WARNER-LAMBERT COMPANY LLC 2004-09-16 US claimed

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-20040180943-A1 Oxazolone analogs as amyloid aggregation inhibitors and for the treatment of alzheimer's disease and disorders related to amyloidosis APP, PSEN1, PSEN2 KMT2A 4782/4885MEN1 2646/4885MAPT 6/4885

“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.