SCHEMBL6847012

SCHEMBL6847012

COc1cc(C(=O)Cn2c(=N)n(Cc3ccccc3)c3ccccc32)cc(C(C)(C)C)c1O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2R P25116 9/20 0.83
MAPT P10636 8/20 0.55
KMT2A Q03164 5/20 0.55
MEN1 O00255 2/20 0.55
KDM4E B2RXH2 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
LMNA P02545 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
MITF O75030 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
NPC1 O15118 1/20 0.48
HPGD P15428 1/20 0.48
RAB9A P51151 1/20 0.48
OXTR P30559 1/20 0.48
AVPR1A P37288 1/20 0.48
BLM P54132 1/20 0.48
TSHR P16473 1/20 0.48

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
Bromide SCHEMBL6753340 0.99 F2R (0.81) F2RMAPTKMT2AMEN1KDM4E
SCHEMBL12393183 0.91 F2R (1.00) F2RMAPTKMT2AMEN1KDM4E
Bromide SCHEMBL6751238 0.90 F2R (0.68) F2RMAPTKMT2AMEN1KDM4E
Bromide SCHEMBL2351227 0.90 F2R (0.98) F2RMAPTKMT2AMEN1KDM4E
Bromide SCHEMBL6752584 0.89 F2R (0.77) F2RMAPTKMT2AMEN1KDM4E
SCHEMBL6846941 0.88 F2R (0.78) F2RMAPTKMT2AMEN1KDM4E
Bromide SCHEMBL6751125 0.87 F2R (0.77) F2RMAPTKMT2AMEN1KDM4E
Bromide SCHEMBL6751231 0.87 F2R (0.80) F2RMAPTKMT2AMEN1KDM4E
Bromide SCHEMBL6751213 0.86 F2R (0.86) F2RMAPTKMT2AMEN1KDM4E
Bromide SCHEMBL6750288 0.86 F2R (0.86) F2RMAPTKMT2AMEN1KDM4E

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
EP-1394152-A1 2-IMINOIMIDAZOLE DERIVATIVES (1) Eisai Co., Ltd. (JP) 2004-03-03 EP disclosed