SCHEMBL7808288

SCHEMBL7808288

CON=C1CC2CCC(C1)N2C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.45
CHRNA7 P36544 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.33
CYP2C9 P11712 1/20 0.33
CHRM2 P08172 2/20 0.32
CHRM1 P11229 2/20 0.32
CHRM3 P20309 2/20 0.32
SLC6A3 Q01959 3/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
ADRA2A P08913 1/20 0.30
DRD2 P14416 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
DRD1 P21728 1/20 0.30
HRH2 P25021 1/20 0.30
ADRA1D P25100 1/20 0.30

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
Hydrochloric Acid SCHEMBL7705509 0.98 HSD11B1 (0.44) HSD11B1CHRNA7MAPK1LMNACYP2C9
SCHEMBL12022394 0.75 MAPK1 (0.43) CHRNA7MAPK1LMNACYP2C9SLC6A3
SCHEMBL15028241 0.74 SLC6A4 (0.37) MAPK1CHRM2CHRM1CHRM3SLC6A3
SCHEMBL1114394 0.73 MAPK1 (0.41) CHRNA7MAPK1LMNACYP2C9CHRM3
Hydrochloric Acid SCHEMBL7809740 0.71 CHRNA7 (0.40) CHRNA7MAPK1LMNACYP2C9CHRM3
SCHEMBL15177769 0.70 HSD11B1 (0.33) HSD11B1CHRM2CHRM1CHRM3
SCHEMBL13547441 0.69 CHRM2 (0.45) HSD11B1CHRNA7CHRM2SLC6A2CHRM4
SCHEMBL9874815 0.69 MAPK1 (0.43) CHRNA7MAPK1CHRM2CHRM1CHRM3
SCHEMBL7893573 0.68 NOS3 (0.31) HSD11B1
SCHEMBL18323812 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0445731-B1 Azabicyclo and azacyclo oxime and amine cholinergic agents and pharmaceutically acceptable salts thereof WARNER LAMBERT CO (US) 1996-01-10 EP claimed
US-20110294749-A1 DIAMINOPYRIMIDINECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2011-12-01 US disclosed
US-8012959-B2 Diaminopyrimidinecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2011-09-06 US disclosed
US-20090281072-A1 Diaminopyrimidinecarboxamide Derivative ASTELLAS PHARM INC. (JP) 2009-11-12 US disclosed
US-20090281072-A1 Diaminopyrimidinecarboxamide Derivative ASTELLAS PHARM INC. (JP) 2009-11-12 US disclosed
US-7449456-B2 Diaminopyrimidinecarboxamide derivative ASTELLAS PHARMA, INC. (JP) 2008-11-11 US disclosed
US-7449456-B2 Diaminopyrimidinecarboxamide derivative ASTELLAS PHARMA, INC. (JP) 2008-11-11 US disclosed
EP-0772613-B1 PROCESS FOR THE PRODUCTION OF AMINOAZOBICYCLOALKANES FROM OXIMES HOFFMANN LA ROCHE (CH) 2001-11-21 EP disclosed
EP-0772613-A2 PROCESS FOR THE PRODUCTION OF AMINOAZOBICYCLOALKANES FROM OXIMES SMITHKLINE BEECHAM PLC (GB) 1997-05-14 EP disclosed
WO-1996003401-A2 PROCESS FOR THE PRODUCTION OF AMINOAZOBICYCLOALKANES FROM OXIMES SMITHKLINE BEECHAM PLC (GB) 1996-02-08 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 (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-20110294749-A1 DIAMINOPYRIMIDINECARBOXAMIDE DERIVATIVE STAT6, STAT4, STAT3 HSD11B1 4665/4885CHRNA7 4376/4885MAPK1 500/4885
US-20090281072-A1 Diaminopyrimidinecarboxamide Derivative STAT6, STAT4, STAT3 HSD11B1 4665/4885CHRNA7 4376/4885MAPK1 500/4885

“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.