SCHEMBL20115855

SCHEMBL20115855

Cc1ccc(C#N)c2c1c1ccccc1n2C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.68
▸ MAPT P10636 1/20 0.68
▸ ALKBH5 Q6P6C2 1/20 0.47
▸ FTO Q9C0B1 1/20 0.47
▸ IMPDH2 P12268 1/20 0.46
▸ EGFR P00533 2/20 0.43
▸ SRC P12931 1/20 0.43
▸ GPR3 P46089 1/20 0.41
▸ GABRP O00591 1/20 0.41
▸ GABRD O14764 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ GABRA2 P47869 1/20 0.41
▸ GABRB2 P47870 1/20 0.41
▸ GABRA4 P48169 1/20 0.41
▸ GABRE P78334 1/20 0.41

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
SCHEMBL18030937 0.89 KDM4E (0.50) KDM4EMAPTALKBH5FTOIMPDH2
SCHEMBL21793460 0.81 KDM4E (1.00) KDM4EMAPTALKBH5FTOGPR3
SCHEMBL17032702 0.77 ALKBH5 (0.58) KDM4EMAPTALKBH5FTOIMPDH2
SCHEMBL20115859 0.76 IMPDH2 (0.47) KDM4EMAPTALKBH5FTOIMPDH2
SCHEMBL18030919 0.73 GPR3 (0.52) KDM4EMAPTALKBH5FTOIMPDH2
SCHEMBL18028318 0.73 ALKBH5 (0.57) KDM4EMAPTALKBH5FTOIMPDH2
SCHEMBL18030949 0.73 EGFR (0.51) KDM4EMAPTALKBH5FTOIMPDH2
SCHEMBL18030924 0.73 EGFR (0.51) KDM4EMAPTIMPDH2EGFRSRC
SCHEMBL18028322 0.72 IMPDH2 (0.46) KDM4EMAPTALKBH5FTOIMPDH2
SCHEMBL18028377 0.72 ALKBH5 (0.56) KDM4EMAPTALKBH5FTOIMPDH2

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
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