SCHEMBL449585

SCHEMBL449585

CCOC(=O)C(C(=O)OCC)=C(C)Cc1ccc(Br)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
MAPK1 P28482 2/20 0.50
S1PR4 O95977 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
S1PR1 P21453 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.43
MME P08473 1/20 0.41
ACE P12821 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 1/20 0.40
CES2 O00748 1/20 0.40
ACHE P22303 1/20 0.40
CES1 P23141 1/20 0.40

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
SCHEMBL7636374 0.81 KMT2A (0.54) KMT2AMEN1MAPK1S1PR4LMNA
SCHEMBL6925456 0.79 KMT2A (0.51) KMT2AMEN1MAPK1S1PR4LMNA
SCHEMBL4733 0.78 CYP1A2 (0.55) KMT2AMEN1MAPK1S1PR4LMNA
SCHEMBL20109336 0.76 MEN1 (0.49) KMT2AMEN1MAPK1S1PR4LMNA
SCHEMBL15964601 0.76 KMT2A (0.49) KMT2AMEN1MAPK1S1PR4LMNA
SCHEMBL20543660 0.76 MEN1 (0.49) KMT2AMEN1MAPK1S1PR4LMNA
SCHEMBL24042814 0.74 MAPT (0.47) KMT2AMEN1MAPK1S1PR4LMNA
SCHEMBL25832046 0.73 MEN1 (0.49) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL12987888 0.73 CYP1A2 (0.51) KMT2AMEN1MAPK1S1PR4LMNA
Ethyl Acetate SCHEMBL27930073 0.73 LMNA (0.48) KMT2AMEN1MAPK1S1PR4LMNA

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-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. 2012-03-15 US disclosed
WO-2011123674-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2011-10-06 WO 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-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES APP, BACE1, PSEN1 KMT2A 3951/4885MEN1 1819/4885MAPK1 1699/4885

“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.