SCHEMBL31070210

SCHEMBL31070210

Fc1ccc(-c2nc3ccc(F)cc3nc2-c2ccc(F)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.64
MAPK14 Q16539 9/20 0.58
MAPK10 P53779 2/20 0.58
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ATM Q13315 1/20 0.46
TLR9 Q9NR96 1/20 0.46
DHODH Q02127 4/20 0.44
NAMPT P43490 1/20 0.44
RAD51 Q06609 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
SCHEMBL1302945 0.91 MAPK14 (0.58) KDM4EMAPK14MAPK10KMT2AALDH1A1
SCHEMBL12578745 0.90 KDM4E (0.59) KDM4EMAPK14MAPK10KMT2AALDH1A1
SCHEMBL12352245 0.89 MAPK14 (0.56) KDM4EMAPK14MAPK10KMT2AALDH1A1
SCHEMBL12578191 0.89 MAPK14 (0.56) KDM4EMAPK14MAPK10KMT2AALDH1A1
SCHEMBL12578631 0.88 KDM4E (0.56) KDM4EMAPK14MAPK10KMT2AALDH1A1
SCHEMBL10281926 0.88 KDM4E (0.58) KDM4EMAPK14MAPK10KMT2AALDH1A1
SCHEMBL12551909 0.88 KDM4E (0.51) KDM4EMAPK14MAPK10KMT2ADHODH
SCHEMBL12111667 0.84 MAPK14 (0.61) KDM4EMAPK14MAPK10KMT2AALDH1A1
SCHEMBL12111626 0.84 MAPK14 (0.61) KDM4EMAPK14MAPK10KMT2AALDH1A1
SCHEMBL12111547 0.84 MAPK14 (0.61) KDM4EMAPK14MAPK10KMT2AALDH1A1

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
CN-118420551-A Method for synthesizing quinoxaline compound by catalytic synthesis of cyclopentadienyl titanium complex 宁夏师范学院 2024-08-02 CN disclosed