SCHEMBL4557220

SCHEMBL4557220

CCCCCC1CCC(N)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.39
SLC6A3 Q01959 3/20 0.39
SLC6A4 P31645 2/20 0.39
DPP4 P27487 4/20 0.38
CYSLTR2 Q9NS75 1/20 0.37
CYSLTR1 Q9Y271 1/20 0.37
BCHE P06276 2/20 0.36
SPHK1 Q9NYA1 1/20 0.36

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
SCHEMBL23330385 0.88 SLC6A2 (0.41) SLC6A2SLC6A3SLC6A4DPP4BCHE
SCHEMBL29117075 0.88 CYSLTR2 (0.44) CYSLTR2CYSLTR1BCHE
SCHEMBL7932145 0.85 CYSLTR2 (0.38) SLC6A2SLC6A3SLC6A4DPP4CYSLTR2
SCHEMBL7932142 0.85 CYSLTR2 (0.38) SLC6A2SLC6A3SLC6A4DPP4CYSLTR2
SCHEMBL7646825 0.85 CYSLTR2 (0.38) SLC6A2SLC6A3SLC6A4DPP4CYSLTR2
SCHEMBL7936083 0.85 CYSLTR2 (0.38) SLC6A2SLC6A3SLC6A4DPP4CYSLTR2
SCHEMBL7936081 0.85 CYSLTR2 (0.38) SLC6A2SLC6A3SLC6A4DPP4CYSLTR2
SCHEMBL13627639 0.80 SLC6A2 (0.44) SLC6A2SLC6A3SLC6A4
SCHEMBL19895392 0.80 CYSLTR2 (0.40) CYSLTR2CYSLTR1BCHE
SCHEMBL19732916 0.80 CYSLTR2 (0.40) CYSLTR2CYSLTR1BCHE

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-101547890-A Catalytic asymmetric synthesis of primary amines via borane reduction of oxime ethers using spiroborate esters INTELLECTUAL PROPERTY AND TECH (US) 2009-09-30 CN disclosed
EP-2061748-A2 CATALYTIC ASYMMETRIC SYNTHESIS OF PRIMARY AMINES VIA BORANE REDUCTION OF OXIME ETHERS USING SPIROBORATE ESTERS Office Of Intellectual Property And Technology (US) 2009-05-27 EP disclosed
WO-2008027740-A2 CATALYTIC ASYMMETRIC SYNTHESIS OF PRIMARY AMINES VIA BORANE REDUCTION OF OXIME ETHERS USING SPIROBORATE ESTERS OFFICE OF INTELLECTUAL PROPERTY AND TECHNOLOGY (US) 2008-03-06 WO disclosed
US-20030149306-A1 Process for the preparation of polymorph of 4-(aryl)-1,2,3,4-tetrahydro-1-naphthale-namine derivative SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2003-08-07 US disclosed
WO-2001072684-B1 PROCESS FOR THE PREPARATION OF POLYMORPH OF 4-(ARYL)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENAMINE DERIVATIVE SUN PHARMACEUTICAL IND LTD (IN) 2001-11-29 WO disclosed
WO-2001072684-B1 PROCESS FOR THE PREPARATION OF POLYMORPH OF 4-(ARYL)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENAMINE DERIVATIVE SUN PHARMACEUTICAL IND LTD (IN) 2001-11-29 WO disclosed
WO-2001072684-A1 PROCESS FOR THE PREPARATION OF POLYMORPH OF 4-(ARYL)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENAMINE DERIVATIVE SUN PHARMACEUTICAL INDUSTRIES LTD. (IN) 2001-10-04 WO disclosed
WO-2001072684-A1 PROCESS FOR THE PREPARATION OF POLYMORPH OF 4-(ARYL)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENAMINE DERIVATIVE SUN PHARMACEUTICAL INDUSTRIES LTD. (IN) 2001-10-04 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-20030149306-A1 Process for the preparation of polymorph of 4-(aryl)-1,2,3,4-tetrahydro-1-naphthale-namine derivative NAMPT, NAT1, VNN1 SLC6A2 79/4885SLC6A3 92/4885SLC6A4 57/4885

“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.