SCHEMBL3587531

SCHEMBL3587531

CN1CCN(c2cc[c]c(Cl)c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 2/20 0.49
HTR3A P46098 1/20 0.47
KDM4E B2RXH2 5/20 0.46
GAA P10253 3/20 0.46
MAPT P10636 3/20 0.46
PTK2B Q14289 2/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
GLA P06280 1/20 0.45
ALDH1A1 P00352 2/20 0.44
GFER P55789 1/20 0.44
ESR2 Q92731 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HRH4 Q9H3N8 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL3140104 0.82 TERT (0.41) KDM4EGAAMAPTMAPK1HTT
SCHEMBL5884761 0.81 HTR3A (0.51) ADRA2CHTR3AKDM4EGAAMAPT
SCHEMBL3143049 0.81 ALDH1A1 (0.43) KDM4EGAAMAPTMAPK1HTT
SCHEMBL1900057 0.81 ALDH1A1 (0.43) KDM4EGAAMAPTMAPK1HTT
SCHEMBL4160667 0.80 ADRA2C (0.47) ADRA2CHTR3AKDM4EGAAMAPT
SCHEMBL15475119 0.80 ADRA2C (0.47) ADRA2CHTR3AKDM4EGAAMAPT
SCHEMBL3511994 0.80 ADRA2C (0.47) ADRA2CHTR3AKDM4EGAAMAPT
SCHEMBL591377 0.80 ADRA2C (0.56) ADRA2CHTR3AKDM4EGAAMAPT
SCHEMBL3132013 0.78 NPSR1 (0.49) KDM4EMAPTRECQLKMT2AMEN1
SCHEMBL541488 0.78 LMNA (0.47) ADRA2CKDM4EGAAMAPTMAPK1

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
US-20100029636-A1 Lck inhibitors NOVARTIS AG (CH) 2010-02-04 US disclosed
CN-101516888-A Pyrazolo [1, 5-a] pyrimidine derivatives and their therapeutic use NOVARTIS AG (CH) 2009-08-26 CN disclosed
US-6911469-B2 Sulfonamide compounds and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-28 US disclosed
US-20040180947-A1 hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-09-16 US disclosed
US-20020099212-A1 For therapy of disease treatable based on a blood sugar level-depressing activity or a disease treatable based on a cGMP-PDE inhibiting activity, smooth muscle relaxing activity, bronchodilating activity, vasodilating activity FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-07-25 US disclosed
US-6348474-B1 COMPOUNDS AS ANTIDIABETIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-19 US disclosed
CN-1268942-A Sulfonamide compounds and medicinal use thereof FUJISAWA PHARMACEUTICAL CO (JP) 2000-10-04 CN disclosed
EP-0995742-A1 SULFONAMIDE COMPOUNDS AND MEDICINAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-26 EP 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-20020099212-A1 For therapy of disease treatable based on a blood sugar level-depressing activity or a disease treatable based on a cGMP-PDE inhibiting activity, smooth muscle relaxing activity, bronchodilating activity, vasodilating activity PDE2A, PDE3A, PDE12 ADRA2C 114/4885HTR3A 218/4885KDM4E 1305/4885
US-20040180947-A1 hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications PDE2A, PDE3A, PYGM ADRA2C 43/4885HTR3A 664/4885KDM4E 935/4885
US-20100029636-A1 Lck inhibitors LCK, ZAP70, FYN ADRA2C 3317/4885HTR3A 3666/4885KDM4E 557/4885

“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.