SCHEMBL6944691

SCHEMBL6944691

OCCCN1CCC(=NO)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.41
TSHR P16473 2/20 0.36
CASP1 P29466 1/20 0.36
HTR5A P47898 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 2/20 0.33
PNMT P11086 1/20 0.33
POLB P06746 1/20 0.33
PIM1 P11309 1/20 0.33
GAA P10253 1/20 0.33
DRD2 P14416 2/20 0.30
DRD3 P35462 2/20 0.30
HRH3 Q9Y5N1 2/20 0.30
CHRM2 P08172 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
CHRM1 P11229 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 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
SCHEMBL8114527 1.00 CHRNA7 (0.41) CHRNA7TSHRCASP1HTR5AMEN1
SCHEMBL6947533 0.94 CHRNA7 (0.39) CHRNA7TSHRCASP1HTR5AMEN1
SCHEMBL8110861 0.94 CHRNA7 (0.39) CHRNA7TSHRCASP1HTR5AMEN1
SCHEMBL6941499 0.92 PNMT (0.41) CHRNA7TSHRCASP1HTR5APNMT
SCHEMBL6949428 0.92 PNMT (0.41) CHRNA7TSHRCASP1HTR5APNMT
SCHEMBL8103261 0.92 PNMT (0.41) CHRNA7TSHRCASP1HTR5APNMT
SCHEMBL8114059 0.92 PNMT (0.41) CHRNA7TSHRCASP1HTR5APNMT
SCHEMBL6942014 0.82 CHRNA7 (0.44) CHRNA7KMT2ADRD2DRD3OPRM1
SCHEMBL6939825 0.82 HRH3 (0.48) CHRNA7TSHRCASP1KMT2ALMNA
SCHEMBL11151443 0.82 CHRNA7 (0.39) CHRNA7TSHRCASP1PNMTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115677567-A Synthesis method of 4-amino-1-piperidinepropanol 大唐环境产业集团股份有限公司 2023-02-03 CN claimed
CN-115677567-A Synthesis method of 4-amino-1-piperidinepropanol 大唐环境产业集团股份有限公司 2023-02-03 CN disclosed
CN-115677567-A Synthesis method of 4-amino-1-piperidinepropanol 大唐环境产业集团股份有限公司 2023-02-03 CN disclosed
US-6642231-B2 Antineoplastic agents, treatment for neuronal injury and degeneration AVENTIS PHARMACEUTICALS INC. 2003-11-04 US disclosed
EP-1056744-B1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMA INC (US) 2003-10-22 EP disclosed
US-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines AVENTISUB II INC. 2003-06-05 US disclosed
US-6479487-B1 INHIBIT CYCLIN DEPENDENT KINASES, PARTICULARLY CDK-2; ANTIAPOPTOSIS AGENT; INHIBITS DEVELOPMENT OF NEOPLASMS AVENTIS PHARMACEUTICALS INC. 2002-11-12 US disclosed
EP-1056744-A1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES Aventis Pharmaceuticals Inc. (US) 2000-12-06 EP disclosed
WO-1999043675-A1 6,9-DISUBSTITUTED 2-[TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMACEUTICALS INC. (US) 1999-09-02 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-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines CDK6, CDK5, CDK2 CHRNA7 3390/4885TSHR 4411/4885CASP1 289/4885

“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.