SCHEMBL6607188

SCHEMBL6607188

c1cn(CCCN2CC[N]CC2)cn1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 6/20 0.57
ACHE P22303 1/20 0.51
PRKCI P41743 1/20 0.47
QPCT Q16769 1/20 0.47
CYP19A1 P11511 2/20 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
SCHEMBL4744809 0.89 TBXAS1 (0.50) TBXAS1ACHEPRKCIQPCTCYP19A1
SCHEMBL19596990 0.84 ACHE (0.64) TBXAS1ACHEPRKCIQPCT
SCHEMBL7739959 0.84 ACHE (0.64) TBXAS1ACHEPRKCIQPCT
SCHEMBL6600770 0.83 ACHE (0.49) TBXAS1ACHEPRKCIQPCTCYP19A1
SCHEMBL13334889 0.81 TBXAS1 (0.65) TBXAS1ACHEPRKCIQPCTCYP19A1
SCHEMBL28158069 0.81 TBXAS1 (0.55) TBXAS1ACHEPRKCIQPCT
SCHEMBL6601932 0.81 TBXAS1 (0.55) TBXAS1ACHEPRKCIQPCT
SCHEMBL9777196 0.80 TBXAS1 (0.85) TBXAS1PRKCICYP19A1
SCHEMBL29284773 0.78 TBXAS1 (0.52) TBXAS1ACHEPRKCIQPCT
Ammonia Solution, Strong SCHEMBL7096678 0.78 TBXAS1 (0.81) TBXAS1PRKCICYP19A1

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
EP-1373252-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT Aventis Pharma S.A. (FR) 2004-01-02 EP disclosed
WO-2002076975-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT AVENTIS PHARMA S.A. (FR) 2002-10-03 WO disclosed