SCHEMBL5848569

SCHEMBL5848569

c1ccc(C(c2ccccc2)N2CCc3ccccc32)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.52
SLC6A4 P31645 4/20 0.52
MAPT P10636 4/20 0.50
GAA P10253 3/20 0.50
TP53 P04637 3/20 0.50
NPSR1 Q6W5P4 3/20 0.48
ALDH1A1 P00352 5/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
USP2 O75604 1/20 0.46
CDK4 P11802 1/20 0.46
ALOX15 P16050 1/20 0.46
CCND1 P24385 1/20 0.46
LMNA P02545 1/20 0.45
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL10527968 0.89 NPSR1 (0.53) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL534412 0.81 SLC6A2 (0.50) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL10802819 0.81 SLC6A2 (0.54) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL5847681 0.81 SLC6A2 (0.54) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL17652441 0.81 SLC6A2 (0.47) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL1963702 0.78 MAPT (0.58) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL14110030 0.76 ALDH1A1 (0.48) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL1102007 0.76 ALDH1A1 (0.48) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL28468088 0.76 ALDH1A1 (0.44) SLC6A2SLC6A4MAPTGAATP53
SCHEMBL12963341 0.75 MAPT (0.55) SLC6A2SLC6A4MAPTGAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103664973-B Spiro-oxindole compounds and their use as therapeutic agents 泽农医药公司 2017-04-19 CN disclosed
CN-102256983-B Spirooxindole compounds and their use as therapeutic agents 泽农医药公司 2017-04-05 CN disclosed
US-7078567-B2 Amination process JOHNSTON JEFFREY N 2006-07-18 US disclosed
US-20040082778-A1 Amination process JOHNSTON JEFFREY N (US) 2004-04-29 US disclosed
US-6670479-B2 An sp2 hybridized radical is reacted with an azomethine group to form pyrrolidine and indole compounds ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. 2003-12-30 US disclosed
WO-2002072547-A1 AMINATION PROCESS ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. (US) 2002-09-19 WO disclosed
US-20020128490-A1 Amination process ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. 2002-09-12 US disclosed
US-4251659-A Polyfluorohydroxyisopropyl-heterocyclic compounds E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-02-17 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-20040082778-A1 Amination process IDO2, INMT, IDO1 SLC6A2 39/4885SLC6A4 46/4885MAPT 4301/4885
US-20020128490-A1 Amination process IDO2, INMT, IDO1 SLC6A2 36/4885SLC6A4 23/4885MAPT 4229/4885

“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.