SCHEMBL7076131

SCHEMBL7076131

C=C(C)C(=O)Oc1ccc2c(c1)[nH]c1ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 7/20 0.52
ELANE P08246 1/20 0.49
KDM4E B2RXH2 4/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
GABRA1 P14867 1/20 0.46
GABRG2 P18507 1/20 0.46
GABRB3 P28472 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MAOA P21397 1/20 0.44
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
AHR P35869 1/20 0.43
CTSV O60911 1/20 0.43
CTSL P07711 1/20 0.43

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
SCHEMBL18256100 0.93 KDM4E (0.51) KIF11ELANEKDM4EGLAGAA
SCHEMBL7076801 0.91 KDM4E (0.56) KIF11ELANEKDM4EGABRA1GABRG2
SCHEMBL1180269 0.85 KDM4E (0.61) KIF11KDM4EGLAGAAGABRA1
SCHEMBL11465819 0.84 KIF11 (0.58) KIF11KDM4EGABRA1GABRG2GABRB3
SCHEMBL11473565 0.84 KIF11 (0.53) KIF11KDM4EGLAGAAGABRA1
SCHEMBL22258836 0.83 KMT2A (0.50) KIF11ELANEKDM4EGLAGAA
SCHEMBL11475456 0.81 KDM4E (0.54) KIF11KDM4EGLAGAAGABRA1
SCHEMBL7072302 0.79 MTNR1A (0.39) KIF11ELANEKDM4EGLAGAA
SCHEMBL11474532 0.79 KIF11 (0.56) KIF11KDM4EGABRA1GABRG2GABRB3
SCHEMBL9723008 0.77 KDM4E (0.53) KIF11KDM4EGABRA1GABRG2GABRB3

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-20030096172-A1 Hologram recording material composition and hologram recording medium DAISO CO., LTD. (JP) 2003-05-22 US disclosed