SCHEMBL11059581

SCHEMBL11059581

Oc1cc(Br)cc2cc3ccccc3nc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 5/20 0.50
ALDH1A1 P00352 5/20 0.48
HPGD P15428 3/20 0.48
MAPT P10636 3/20 0.48
ACHE P22303 2/20 0.48
GLA P06280 2/20 0.48
GAA P10253 2/20 0.46
KDM4E B2RXH2 2/20 0.46
STAT3 P40763 1/20 0.46
TDP1 Q9NUW8 1/20 0.42
KMT2A Q03164 4/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RAB9A P51151 1/20 0.40
MYC P01106 1/20 0.40
MAX P61244 1/20 0.40
LMNA P02545 1/20 0.39
PRNP P04156 1/20 0.39
HTT P42858 1/20 0.39
NOD2 Q9HC29 1/20 0.39
HTR3A P46098 1/20 0.38

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
SCHEMBL802228 0.77 ACHE (0.61) NQO2ALDH1A1HPGDMAPTACHE
SCHEMBL2392615 0.76 ACHE (0.59) NQO2ALDH1A1HPGDMAPTACHE
SCHEMBL31746104 0.76 ACHE (0.59) NQO2ALDH1A1HPGDMAPTACHE
SCHEMBL7913572 0.71 MAPT (0.65) NQO2ALDH1A1HPGDMAPTACHE
SCHEMBL667881 0.71 ALDH1A1 (0.59) NQO2ALDH1A1HPGDMAPTACHE
SCHEMBL3347624 0.70 KDM4E (0.57) MAPTKDM4ETDP1KMT2ARAB9A
SCHEMBL28573272 0.69 ALDH1A1 (0.56) NQO2ALDH1A1HPGDMAPTACHE
SCHEMBL4902020 0.69 ALDH1A1 (0.70) NQO2ALDH1A1HPGDMAPTACHE
SCHEMBL18842652 0.69 ALDH1A1 (0.50) NQO2ALDH1A1HPGDMAPTACHE
SCHEMBL3370264 0.69 NQO2 (0.61) NQO2ALDH1A1HPGDMAPTGLA

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
US-4452792-A Acridine substituted phosphorus compounds and their insecticidal use VELSICOL CHEMICAL CORPORATION (US) 1984-06-05 US disclosed