SCHEMBL4002137

SCHEMBL4002137

CON(C)C(=O)CCCN1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.45
ALDH1A1 P00352 2/20 0.44
PAOX Q6QHF9 1/20 0.44
TDP1 Q9NUW8 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
GAA P10253 1/20 0.41
KEAP1 Q14145 1/20 0.41
LMNA P02545 3/20 0.40
KDM4E B2RXH2 2/20 0.40
TSHR P16473 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
RAB9A P51151 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
SCHEMBL4895254 0.84 PAOX (0.49) ALDH1A1PAOXSMN1; SMN2LMNATSHR
SCHEMBL31242949 0.80 KDM4E (0.48) ALDH1A1TDP1SMN1; SMN2GAALMNA
SCHEMBL11738960 0.77 GLA (0.63) GLAALDH1A1PAOXTDP1SMN1; SMN2
SCHEMBL5337712 0.75 CHRM1 (0.51) ALDH1A1TSHR
SCHEMBL866526 0.74 PAOX (0.71) GLAALDH1A1PAOXSMN1; SMN2GAA
SCHEMBL1127670 0.74 L3MBTL1 (0.63) GLAALDH1A1PAOXTDP1LMNA
SCHEMBL11439673 0.74 EPHX1 (0.47) GLAALDH1A1PAOXGAAKDM4E
SCHEMBL6502976 0.73 ALDH1A1 (0.50) GLAALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL24703880 0.73 ALDH1A1 (0.42) ALDH1A1LMNATSHR
SCHEMBL22205611 0.73 LMNA (0.44) ALDH1A1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7547779-B2 Preparation of 1,6-disubstituted azabenzimidazoles as kinase inhibitors GLAXO GROUP LIMITED (GB) 2009-06-16 US disclosed
EP-1675552-A4 PREPERATION OF 1,6-DISUBSTITUTED AZABENZIMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LTD (GB) 2009-06-03 EP disclosed
US-20080234261-A1 Preparation of 1,6-Disubstituted Azabenzimidazoles as Kinase Inhibitors GLAXOSMITHKLINE LLC 2008-09-25 US disclosed
EP-1675552-A2 PREPERATION OF 1,6-DISUBSTITUTED AZABENZIMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2006-07-05 EP disclosed
WO-2005037197-A2 PREPERATION OF 1,6-DISUBSTITUTED AZABENZIMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-04-28 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-20080234261-A1 Preparation of 1,6-Disubstituted Azabenzimidazoles as Kinase Inhibitors TNK2, ROCK1, ARHGDIB GLA 3938/4885ALDH1A1 4395/4885PAOX 4065/4885

“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.