SCHEMBL4559342

SCHEMBL4559342

Cc1ccc(NC(=O)N2CCC2)cc1C

nearest known ligand 0.91

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.91
NPC1 O15118 5/20 0.91
HTT P42858 2/20 0.72
L3MBTL1 Q9Y468 2/20 0.72
KDM4E B2RXH2 2/20 0.62
ALOX12 P18054 1/20 0.62
TP53 P04637 2/20 0.61
MAPT P10636 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
NFKB1 P19838 1/20 0.61
NFKB2 Q00653 1/20 0.61
RELA Q04206 1/20 0.61
ALDH1A1 P00352 2/20 0.60
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
GLA P06280 1/20 0.57
GAA P10253 1/20 0.57
HPGD P15428 1/20 0.57
KLK7 P49862 1/20 0.57

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
SCHEMBL2097729 0.87 RAB9A (0.74) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL672008 0.84 RAB9A (0.75) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL19180399 0.83 RAB9A (0.73) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL17346760 0.83 RAB9A (0.78) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL25668726 0.83 RAB9A (0.73) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL1575749 0.81 NPC1 (0.70) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL25668730 0.81 RAB9A (0.71) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL9283129 0.80 RAB9A (0.65) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL1610477 0.80 RAB9A (0.65) RAB9ANPC1HTTL3MBTL1KDM4E
SCHEMBL1574714 0.80 RAB9A (0.72) RAB9ANPC1HTTL3MBTL1TP53

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-20090137549-A1 Novel compounds useful for the treatment of degenerative & inflamatory diseases GALAPAGOS NV (BE) 2009-05-28 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-20090137549-A1 Novel compounds useful for the treatment of degenerative & inflamatory diseases PDE4A, PDE7B, PDE4B RAB9A 1318/4885NPC1 3876/4885HTT 2839/4885

“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.