SCHEMBL28200632

SCHEMBL28200632

Oc1cccc2ccc(C=Cc3ccccc3)nc12.[AlH3]

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD74 P04233 1/20 0.77
MIF P14174 1/20 0.77
KMT2A Q03164 14/20 0.73
MEN1 O00255 13/20 0.73
NPC1 O15118 13/20 0.73
RAB9A P51151 11/20 0.72
KDM4E B2RXH2 5/20 0.72
SMN1; SMN2 Q16637 5/20 0.72
POLB P06746 2/20 0.72
MAPT P10636 4/20 0.68
HTT P42858 4/20 0.68
LMNA P02545 3/20 0.68
PKM P14618 1/20 0.68
NFKB1 P19838 1/20 0.68
NFKB2 Q00653 1/20 0.68
RELA Q04206 1/20 0.68
HSP90AA1 P07900 4/20 0.64
AGTR1 P30556 4/20 0.64
CYP1A2 P05177 1/20 0.64
ECE2 P0DPD6 1/20 0.64

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
SCHEMBL3317100 0.98 CD74 (0.79) CD74MIFKMT2AMEN1NPC1
SCHEMBL3319480 0.98 CD74 (0.79) CD74MIFKMT2AMEN1NPC1
SCHEMBL6428720 0.97 CD74 (0.77) CD74MIFKMT2AMEN1NPC1
SCHEMBL8344151 0.87 CD74 (1.00) CD74MIFKMT2AMEN1NPC1
SCHEMBL28473988 0.86 CD74 (0.75) CD74MIFKMT2AMEN1NPC1
SCHEMBL28473985 0.86 CD74 (0.75) CD74MIFKMT2AMEN1NPC1
SCHEMBL3854732 0.81 MEN1 (0.77) CD74MIFKMT2AMEN1NPC1
SCHEMBL7691066 0.81 MEN1 (0.76) CD74MIFKMT2AMEN1NPC1
SCHEMBL29084196 0.81 CD74 (0.72) CD74MIFKMT2AMEN1NPC1
SCHEMBL7691068 0.81 MEN1 (0.76) CD74MIFKMT2AMEN1NPC1

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
CN-107721921-A A kind of new 8 hydroxyquinoline aluminum green light material of Wavelength tunable and preparation method thereof 广州工程技术职业学院 2018-02-23 CN disclosed