SCHEMBL4773978

SCHEMBL4773978

NCc1ccnc2c1CCN2

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.39
NNMT P40261 2/20 0.37
AKT1S1 Q96B36 4/20 0.34
AOC1 P19801 3/20 0.33
AOC3 Q16853 3/20 0.33
PARP1 P09874 1/20 0.30

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
Hydrochloric Acid SCHEMBL4101024 0.98 LOXL2 (0.38) LOXL2NNMTAKT1S1AOC1AOC3
Hydrochloric Acid SCHEMBL3149777 0.98 LOXL2 (0.38) LOXL2NNMTAKT1S1AOC1AOC3
Hydrochloric Acid SCHEMBL4974636 0.98 LOXL2 (0.38) LOXL2NNMTAKT1S1AOC1AOC3
SCHEMBL11987587 0.81 HTR2C (0.43) NNMTPARP1
SCHEMBL13138806 0.75 PARP1 (0.42) NNMTAKT1S1PARP1
SCHEMBL14420679 0.74 ADRB2 (0.41) LOXL2
SCHEMBL797186 0.71 UHRF1 (0.41) NNMTAKT1S1PARP1
SCHEMBL580706 0.71 NNMT (0.37) NNMT
SCHEMBL13991574 0.71 PARP10 (0.42) NNMT
SCHEMBL795352 0.71 NNMT (0.44) NNMTPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562933-B1 SUBSTITUTED AMINE DERIVATIVES AND METHODS OF USE IN THE TREATMENT OF ANGIOGENESIS RELATED DISORDERS AMGEN INC (US) 2008-03-19 EP disclosed