SCHEMBL7307532

SCHEMBL7307532

CC(C)c1cc(CN2CCNCC2)cc(C(C)C)c1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.68
MAPK1 P28482 1/20 0.59
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
SIGMAR1 Q99720 1/20 0.46
GSR P00390 1/20 0.45
CXCR4 P61073 5/20 0.42
TDP1 Q9NUW8 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
ADRA2C P18825 1/20 0.42
CCR2 P41597 1/20 0.42
CXCL12 P48061 1/20 0.42
BLM P54132 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRA5 P31644 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
SCHEMBL9416948 0.88 MAPT (0.78) MAPTMAPK1MEN1KMT2AGSR
SCHEMBL5573539 0.85 MAPT (0.73) MAPTMAPK1MEN1KMT2AGSR
SCHEMBL5573492 0.83 MAPT (0.71) MAPTMAPK1MEN1KMT2AGSR
SCHEMBL9416988 0.82 MAPT (0.69) MAPTMAPK1MEN1KMT2AGSR
SCHEMBL9416936 0.81 MAPT (1.00) MAPTMAPK1MEN1KMT2AGSR
SCHEMBL9733983 0.79 MAPT (0.65) MAPTMAPK1MEN1KMT2AGSR
SCHEMBL7098425 0.78 SIGMAR1 (0.50) MAPTMEN1KMT2ASIGMAR1CXCR4
SCHEMBL8293827 0.75 SIGMAR1 (0.55) MEN1KMT2ASIGMAR1CXCR4TDP1
SCHEMBL20865904 0.75 SIGMAR1 (0.44) MAPTMEN1KMT2ASIGMAR1CXCR4
SCHEMBL7093421 0.74 ALDH1A1 (0.71) MAPTMAPK1MEN1KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5519023-A SCHIZOPHRENIA ADIR ET COMPAGNIE (FR) 1996-05-21 US disclosed
EP-0580503-B1 Aminoalkylchromones, process for their preparation and compositions containing them ADIR (FR) 1995-06-14 EP disclosed
EP-0580503-A1 Aminoalkylchromones, process for their preparation and compositions containing them ADIR ET COMPAGNIE (FR) 1994-01-26 EP disclosed