SCHEMBL6601932

SCHEMBL6601932

c1cn(CCCN2CCNCC2)cn1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 7/20 0.55
ACHE P22303 1/20 0.50
PRKCI P41743 1/20 0.46
CXCR4 P61073 2/20 0.46
QPCT Q16769 1/20 0.46
KMT2A Q03164 1/20 0.42
KDM1A O60341 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
SCHEMBL591937 0.89 TBXAS1 (0.48) TBXAS1ACHEQPCTKDM1A
SCHEMBL19596990 0.82 ACHE (0.64) TBXAS1ACHEPRKCIQPCT
SCHEMBL7739959 0.82 ACHE (0.64) TBXAS1ACHEPRKCIQPCT
SCHEMBL6607188 0.81 TBXAS1 (0.57) TBXAS1ACHEPRKCIQPCT
SCHEMBL13334889 0.80 TBXAS1 (0.65) TBXAS1ACHEPRKCIQPCT
SCHEMBL28158069 0.79 TBXAS1 (0.55) TBXAS1ACHEPRKCIQPCT
SCHEMBL9777196 0.79 TBXAS1 (0.85) TBXAS1PRKCI
SCHEMBL29284773 0.77 TBXAS1 (0.52) TBXAS1ACHEPRKCIQPCT
Ammonia Solution, Strong SCHEMBL7096678 0.77 TBXAS1 (0.81) TBXAS1PRKCI
SCHEMBL22180878 0.76 ACHE (0.53) TBXAS1ACHEPRKCIQPCTKMT2A

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 5 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
US-5144035-A Chemical intermediates for platelet activating factor antagonists YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-09-01 US disclosed
US-4948795-A PLATELET ACTIVATING FACTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1990-08-14 US disclosed
EP-0350145-A2 Pyridylthiazolidine carboxamide derivatives and their intermediates and production of both YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1990-01-10 EP disclosed