SCHEMBL3580293

SCHEMBL3580293

CCCCNC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.74
ALDH1A1 P00352 2/20 0.74
MAPT P10636 2/20 0.74
MEN1 O00255 1/20 0.74
KMT2A Q03164 1/20 0.74
HDAC3 O15379 2/20 0.71
HDAC1 Q13547 2/20 0.71
HDAC2 Q92769 2/20 0.71
HDAC8 Q9BY41 1/20 0.71
HDAC6 Q9UBN7 1/20 0.71
MAPK1 P28482 2/20 0.66
LMNA P02545 2/20 0.66
GAA P10253 1/20 0.66
HTT P42858 1/20 0.66
ESRRG P62508 4/20 0.64
RAB9A P51151 5/20 0.64
NPC1 O15118 3/20 0.64
L3MBTL1 Q9Y468 2/20 0.64
TP53 P04637 1/20 0.64
HPGD P15428 1/20 0.64

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
SCHEMBL13577905 0.95 SMN1; SMN2 (0.81) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL14615882 0.89 RAB9A (0.68) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL9490980 0.89 SMN1; SMN2 (0.73) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL28326194 0.89 L3MBTL1 (0.73) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL6359328 0.85 MLYCD (0.66) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL11960439 0.85 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL17141782 0.83 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL13577906 0.83 MLYCD (0.73) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL15320627 0.83 TMEM97 (0.61) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL22919705 0.82 L3MBTL1 (0.65) SMN1; SMN2ALDH1A1HTTRAB9ANPC1

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-7678818-B2 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-16 US disclosed
US-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. 2007-09-20 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-20070219261-A1 Anthranilamide and 2-amino-heteroarene-carboxamide compounds AADAT, AAAS, AADAC SMN1; SMN2 2333/4885ALDH1A1 1414/4885MAPT 2786/4885

“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.