SCHEMBL4597012

SCHEMBL4597012

CC(=O)CCc1cn(C)nc1C

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 5/20 0.42
USP2 O75604 1/20 0.42
NPC1 O15118 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 3/20 0.39
TSHR P16473 1/20 0.39
GAA P10253 1/20 0.39
IAPP P10997 1/20 0.39
HTT P42858 1/20 0.38
FEN1 P39748 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL26896076 0.83 L3MBTL1 (0.46) L3MBTL1RAB9ASMN1; SMN2ALDH1A1USP2
SCHEMBL12094465 0.75 L3MBTL1 (0.40) L3MBTL1RAB9ASMN1; SMN2ALDH1A1USP2
SCHEMBL12293927 0.74
SCHEMBL4351357 0.74 RAB9A (0.44) L3MBTL1RAB9ASMN1; SMN2ALDH1A1USP2
SCHEMBL8470999 0.74 RAB9A (0.58) RAB9ASMN1; SMN2ALDH1A1USP2NPC1
SCHEMBL4208861 0.73 RAB9A (0.43) RAB9ASMN1; SMN2ALDH1A1USP2NPC1
SCHEMBL3269319 0.72
SCHEMBL18083218 0.72 L3MBTL1 (0.38) L3MBTL1RAB9ASMN1; SMN2ALDH1A1USP2
SCHEMBL13732223 0.71 RAB9A (0.59) RAB9ASMN1; SMN2ALDH1A1USP2NPC1
SCHEMBL1639886 0.71 GAA (0.51) RAB9ASMN1; SMN2ALDH1A1NPC1MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080267942-A1 BENZAZEPIN-2(1H)-ONE DERIVATIVES PFIZER LIMITED (GB) 2008-10-30 US disclosed
WO-2008050207-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANABOLIC AGENTS FOR LIVESTOCK ANIMALS PFIZER LIMITED (GB) 2008-05-02 WO disclosed
US-20080103130-A1 7-hydroxy-6-{[1-methyl-3-(1,3-thiazol-5-yl)propyl]amino}-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1]benzazepin-2(1H)-one; agonists at the beta-2 adrenoceptor; feed additives for livestock animals; improving meat yield or meat quality PFIZER LIMITED (GB) 2008-05-01 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 (2 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-20080103130-A1 7-hydroxy-6-{[1-methyl-3-(1,3-thiazol-5-yl)propyl]amino}-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1]benzazepin-2(1H)-one; agonists at the beta-2 adrenoceptor; feed additives for livestock animals; improving meat yield or meat quality ADRB2, ADRB1, ADRA2C L3MBTL1 3143/4885RAB9A 4414/4885SMN1; SMN2 1803/4885
US-20080267942-A1 BENZAZEPIN-2(1H)-ONE DERIVATIVES ADRB2, ADRB1, ADRA2C L3MBTL1 3345/4885RAB9A 3565/4885SMN1; SMN2 2020/4885

“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.