SCHEMBL18670747

SCHEMBL18670747

CC(=O)NCCCOCCOCCCN

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 3/20 0.62
KDM4E B2RXH2 1/20 0.50
MAPK1 P28482 1/20 0.50
HIF1A Q16665 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.46
ADRA1A P35348 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MTNR1A P48039 4/20 0.40
MTNR1B P49286 4/20 0.40
CHRNA1 P02708 1/20 0.39
CHRNG P07510 1/20 0.39
CHRNB1 P11230 1/20 0.39
CHRND Q07001 1/20 0.39
TLR2 O60603 1/20 0.39
RAB9A P51151 2/20 0.38
TSHR P16473 1/20 0.38
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL15185814 1.00 PAOX (0.62) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL12444633 0.93 PAOX (0.69) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL5693542 0.90 KDM4E (0.61) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL13588485 0.87 PAOX (0.49) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL27160328 0.87 PAOX (0.60) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL19140763 0.83 PAOX (0.66) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL15185827 0.82 SMN1; SMN2 (0.55) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL18947953 0.82 HPGD (0.53) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL14289054 0.82 KDM4E (0.52) PAOXKDM4EMAPK1HIF1AL3MBTL1
SCHEMBL21806080 0.82 PAOX (0.39) PAOXSMN1; SMN2CHRNA1CHRNGCHRNB1

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-20200385369-A1 NEW BENZIMIDAZOLES DERIVATIVES AS TEC KINASES FAMILY INHIBITORS GB005 INC (US) 2020-12-10 US disclosed
US-10562893-B2 Benzimidazoles derivatives as Tec kinases family inhibitors GB005, INC. (US) 2020-02-18 US disclosed
US-20180319781-A1 NEW BENZIMIDAZOLES DERIVATIVES AS TEC KINASES FAMILY INHIBITORS GB005, INC. 2018-11-08 US disclosed
EP-3353170-A1 NEW BENZIMIDAZOLES DERIVATIVES AS TEC KINASES FAMILY INHIBITORS Pharmascience Inc. (CA) 2018-08-01 EP disclosed
WO-2017049401-A1 NEW BENZIMIDAZOLES DERIVATIVES AS TEC KINASES FAMILY INHIBITORS PHARMASCIENCE INC. (CA) 2017-03-30 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 (3 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-10562893-B2 Benzimidazoles derivatives as Tec kinases family inhibitors BMX, TEC, BTK PAOX 2351/4885KDM4E 2460/4885MAPK1 275/4885
US-20180319781-A1 NEW BENZIMIDAZOLES DERIVATIVES AS TEC KINASES FAMILY INHIBITORS BMX, TEC, BTK PAOX 2060/4885KDM4E 2473/4885MAPK1 254/4885
US-20200385369-A1 NEW BENZIMIDAZOLES DERIVATIVES AS TEC KINASES FAMILY INHIBITORS BMX, TEC, BTK PAOX 2096/4885KDM4E 2440/4885MAPK1 261/4885

“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.