SCHEMBL4157447

SCHEMBL4157447

CCN(CC)c1ccc(-n2ccnc2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 1/20 0.48
▸ PSEN2 P49810 1/20 0.48
▸ APH1B Q8WW43 1/20 0.48
▸ NCSTN Q92542 1/20 0.48
▸ APH1A Q96BI3 1/20 0.48
▸ PSENEN Q9NZ42 1/20 0.48
▸ S100B P04271 1/20 0.46
▸ PDE4A P27815 1/20 0.46
▸ PDE4B Q07343 1/20 0.46
▸ PDE4C Q08493 1/20 0.46
▸ PDE4D Q08499 1/20 0.46
▸ CYP19A1 P11511 2/20 0.41
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ TERT O14746 1/20 0.40
▸ CYP2C19 P33261 5/20 0.40
▸ CYP1A2 P05177 4/20 0.40
▸ CYP3A4 P08684 4/20 0.40
▸ CYP2D6 P10635 4/20 0.40
▸ CYP2C9 P11712 4/20 0.40

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
SCHEMBL13997437 0.78 CYP3A4 (0.44) PDE4APDE4BPDE4CPDE4DCYP19A1
SCHEMBL1885632 0.77 CYP3A4 (0.46) PDE4APDE4BPDE4CPDE4DCYP19A1
SCHEMBL8439508 0.76 CYP3A4 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12391451 0.75 ALDH1A1 (0.57) PDE4APDE4BPDE4CPDE4DCYP19A1
SCHEMBL6835451 0.74 MAPT (0.53) PDE4APDE4BPDE4CPDE4DCYP19A1
SCHEMBL16983194 0.74 IDO1 (0.61) PDE4APDE4BPDE4CPDE4DCYP19A1
SCHEMBL8283425 0.74 CYP3A4 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL29105016 0.74 IDO1 (0.47) PDE4APDE4BPDE4CPDE4DCYP19A1
SCHEMBL9260647 0.73 LMNA (0.48) PDE4APDE4BPDE4CPDE4DCYP19A1
SCHEMBL11843322 0.73 CYP19A1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215097-A1 Novel Polymer and Method of Measuring Cholesterol Therewith WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2009-08-27 — — US disclosed
EP-0819765-A2 Reagent for measuring an amount of cholesterol WAKO PURE CHEMICAL INDUSTRIES, LTD (JP) 1998-01-21 — — EP disclosed
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