SCHEMBL28025010

SCHEMBL28025010

COC(=O)c1c(C(F)(F)F)[nH]c2c(OC)cccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.53
GLA P06280 1/20 0.53
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 4/20 0.48
HPGD P15428 4/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
POLB P06746 2/20 0.48
MAPT P10636 2/20 0.48
MCL1 Q07820 2/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
RECQL P46063 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44

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
SCHEMBL28025006 0.90 KDM4E (0.49) GAAGLAALDH1A1KDM4EHPGD
SCHEMBL28206985 0.88 KDM4E (0.56) GAAGLAALDH1A1KDM4EHPGD
SCHEMBL28025012 0.85 NR4A2 (0.49) GAAALDH1A1KDM4EHPGDMEN1
SCHEMBL28025015 0.84 NR4A2 (0.50) GAAALDH1A1KDM4EHPGDMEN1
SCHEMBL28206982 0.83 PBRM1 (0.42) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL7218658 0.80 NR4A2 (0.59) GAAGLAALDH1A1KDM4EHPGD
SCHEMBL28024562 0.79 LMNA (0.52) GAAALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL20867843 0.77 NR4A2 (0.63) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL28206986 0.74 KDM4E (0.52) GAAALDH1A1KDM4EHPGDMEN1
SCHEMBL28062943 0.74 DAO (0.41) GAAGLAALDH1A1KDM4EHPGD

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
CN-105646327-A 2-perfluoroalkyl indole derivative and synthesis method thereof 上海大学 2016-06-08 CN disclosed
CN-104892485-A 2-perfluoroalkyl indole derivative and synthesis method thereof UNIV SHANGHAI 2015-09-09 CN disclosed