SCHEMBL11399599

SCHEMBL11399599

Oc1cccc2c(NCc3ccccc3)cccc12

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 7/20 0.83
KDM4E B2RXH2 4/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
MAPT P10636 3/20 0.56
ALDH1A1 P00352 2/20 0.56
THRB P10828 1/20 0.56
ALOX12 P18054 1/20 0.56
HSD17B10 Q99714 2/20 0.50
GRM2 Q14416 1/20 0.50
GAA P10253 1/20 0.49
MAPK1 P28482 1/20 0.49
HTT P42858 1/20 0.49
BLM P54132 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CDC25B P30305 1/20 0.49
CA12 O43570 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
HPGD P15428 2/20 0.46

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
SCHEMBL6677663 0.91 IDO1 (1.00) IDO1KDM4EMEN1KMT2AMAPT
SCHEMBL6541555 0.89 IDO1 (0.69) IDO1KDM4EMEN1KMT2AMAPT
SCHEMBL31006473 0.89 IDO1 (0.69) IDO1KDM4EMEN1KMT2AMAPT
SCHEMBL12086889 0.85 IDO1 (0.61) IDO1KDM4EMEN1KMT2AMAPT
SCHEMBL268673 0.83 KDM4E (0.78) IDO1KDM4EMEN1KMT2AMAPT
SCHEMBL11509875 0.81 MAPT (0.59) IDO1KDM4EMEN1KMT2AMAPT
SCHEMBL12086902 0.81 IDO1 (0.56) IDO1KDM4EMEN1KMT2AMAPT
Bromide SCHEMBL10436174 0.81 KDM4E (0.75) IDO1KDM4EMEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL6266755 0.81 KDM4E (0.75) IDO1KDM4EMEN1KMT2AMAPT
SCHEMBL30374630 0.79 KDM4E (0.68) IDO1KDM4EMEN1KMT2AMAPT

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
EP-0030314-A1 Water-insoluble monoazo dyestuffs, their preparation and use in dyeing and printing synthetic polymeric materials AZIENDE COLORI NAZIONALI AFFINI ACNA S.P.A. (IT) 1981-06-17 EP disclosed
US-3993619-A AZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1976-11-23 US disclosed