SCHEMBL4093686

SCHEMBL4093686

CC(=O)c1ccc(N2CCOCC2)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.61
MAPT P10636 5/20 0.61
KMT2A Q03164 4/20 0.61
MEN1 O00255 3/20 0.61
LMNA P02545 3/20 0.61
HTT P42858 3/20 0.61
MAPK1 P28482 1/20 0.61
RAB9A P51151 4/20 0.59
NPC1 O15118 3/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
GAA P10253 1/20 0.55
ALDH1A1 P00352 4/20 0.55
POLB P06746 1/20 0.55
ALDH3A1 P30838 1/20 0.55
ALDH1A3 P47895 1/20 0.55
AKR1C3 P42330 1/20 0.54
TSHR P16473 2/20 0.53
HPGD P15428 3/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52

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
SCHEMBL34467400 0.89 SMN1; SMN2 (0.53) SMN1; SMN2MAPTKMT2AMEN1LMNA
SCHEMBL30689191 0.86 SMN1; SMN2 (0.59) SMN1; SMN2MAPTKMT2AMEN1LMNA
SCHEMBL1665694 0.86 SMN1; SMN2 (0.59) SMN1; SMN2MAPTKMT2AMEN1LMNA
SCHEMBL17407220 0.84 ALDH1A1 (0.58) SMN1; SMN2MAPTKMT2AMEN1LMNA
SCHEMBL2744730 0.84 SMN1; SMN2 (0.59) SMN1; SMN2MAPTKMT2AMEN1LMNA
SCHEMBL11216126 0.84 KDM4E (0.55) SMN1; SMN2MAPTKMT2AMEN1LMNA
SCHEMBL17395881 0.83 NPC1 (0.68) SMN1; SMN2MAPTLMNARAB9ANPC1
SCHEMBL6955366 0.83 ALDH1A1 (0.71) SMN1; SMN2MAPTKMT2AMEN1LMNA
SCHEMBL937684 0.83 MAPT (0.55) SMN1; SMN2MAPTLMNAHTTRAB9A
SCHEMBL11062391 0.82 SMN1; SMN2 (0.55) SMN1; SMN2MAPTKMT2AMEN1LMNA

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-20090069288-A1 Novel therapeutic compounds ABBVIE INC. 2009-03-12 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-20090069288-A1 Novel therapeutic compounds MAP3K20, RPS6KB1, MAP3K1 SMN1; SMN2 3501/4885MAPT 3755/4885KMT2A 3833/4885

“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.