SCHEMBL20115841

SCHEMBL20115841

Cc1cccc2c1c1ccccc1n2-c1ccc2c(c1)c1ccccc1n2C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 1/20 0.47
FTO Q9C0B1 1/20 0.47
KDM4E B2RXH2 5/20 0.46
MAPT P10636 4/20 0.46
GPR3 P46089 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PABPC1 P11940 1/20 0.40
NQO2 P16083 2/20 0.40
ATM Q13315 1/20 0.40
NPY5R Q15761 1/20 0.39
TOP2A P11388 2/20 0.38
KIF11 P52732 1/20 0.37
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35

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
SCHEMBL20115878 0.91 ALKBH5 (0.47) ALKBH5FTOKDM4EMAPTGPR3
SCHEMBL26226125 0.89 KDM4E (0.40) ALKBH5FTOKDM4EMAPTGPR3
SCHEMBL16791290 0.86 GPR3 (0.61) ALKBH5FTOKDM4EMAPTGPR3
SCHEMBL10450123 0.86 GPR3 (0.61) ALKBH5FTOKDM4EMAPTGPR3
SCHEMBL11940264 0.86 GPR3 (0.61) ALKBH5FTOKDM4EMAPTGPR3
SCHEMBL22906563 0.86 GPR3 (0.46) ALKBH5FTOKDM4EMAPTGPR3
SCHEMBL23373459 0.85 KDM4E (0.55) KDM4EMAPTGPR3L3MBTL1HTT
SCHEMBL25943019 0.85 KDM4E (0.40) ALKBH5FTOKDM4EMAPTGPR3
SCHEMBL26310628 0.85 KDM4E (0.37) ALKBH5FTOKDM4EMAPTL3MBTL1
SCHEMBL4402782 0.85 KDM4E (0.55) ALKBH5FTOKDM4EMAPTGPR3

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-3061759-B1 NITRILE SUBSTITUTED DIBENZOFURANS IDEMITSU KOSAN CO (JP) 2019-12-25 EP disclosed
EP-3119770-B1 NEW DIBENZOFURANS AND DIBENZOTHIOPHENES IDEMITSU KOSAN CO (JP) 2018-05-02 EP disclosed