SCHEMBL11263550

SCHEMBL11263550

NCCOc1ccc2cc3c([Cu])cc(OCCN)cc3nc2c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 9/20 0.42
FGFR1 P11362 1/20 0.42
MAPT P10636 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
LTA4H P09960 2/20 0.35
PLA2G2A P14555 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MIF P14174 2/20 0.34

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
SCHEMBL11256198 0.83 NCF1 (0.53) NCF1FGFR1MAPTTAAR1LTA4H
Hydrochloric Acid SCHEMBL11374329 0.81 NCF1 (0.51) NCF1FGFR1MAPTTAAR1LTA4H
SCHEMBL11263553 0.81 NCF1 (0.51) NCF1FGFR1MAPTTAAR1LTA4H
Hydrochloric Acid SCHEMBL11262673 0.81 NCF1 (0.51) NCF1FGFR1MAPTTAAR1LTA4H
SCHEMBL23452963 0.72 NCF1 (0.76) NCF1
Hydrochloric Acid SCHEMBL11262065 0.72 NCF1 (0.49) NCF1MAPT
SCHEMBL24272398 0.68 CYP3A4 (0.60) NCF1FGFR1MAPTTAAR1LTA4H
SCHEMBL23453148 0.68 NCF1 (0.77) NCF1MAPT
SCHEMBL6125755 0.67 NCF1 (0.43) NCF1FGFR1TAAR1
SCHEMBL9828364 0.66 NCF1 (0.49) NCF1MAPTALDH1A1CASP1CASP7

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-4314061-A Certain 3,6-bis-(heteroaminoalkoxy) acridines AMERICAN CYANAMID COMPANY 1982-02-02 US disclosed
EP-0031407-A1 Substituted 3,6 bis-(aminoalkoxy)acridines, and a process for their preparation AMERICAN CYANAMID COMPANY (US) 1981-07-08 EP disclosed