SCHEMBL8340912

SCHEMBL8340912

Cc1c(C(F)(F)F)[nH]c(=O)n(-c2ccc3snc(-c4ccccc4O)c3c2)c1=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
CASR P41180 1/20 0.32
TP53 P04637 3/20 0.32
KMT2A Q03164 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
HSP90AA1 P07900 1/20 0.31
HSD17B10 Q99714 2/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
MEN1 O00255 2/20 0.30
ARF6 P62330 1/20 0.30
NPC1 O15118 1/20 0.30
GAA P10253 1/20 0.30
CNR1 P21554 1/20 0.30

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
SCHEMBL8345599 0.84 ALDH1A1 (0.32) TP53KMT2ALMNATSHRHTT
SCHEMBL8345319 0.81 ALDH1A1 (0.39) MAPTTP53KMT2ASMN1; SMN2LMNA
SCHEMBL8341718 0.81 KDM4E (0.39) TP53KMT2ASMN1; SMN2LMNATSHR
SCHEMBL8340623 0.81
SCHEMBL8342309 0.80 KDM4E (0.32) TP53KMT2ALMNAALDH1A1KDM4E
SCHEMBL7141262 0.80 KDM4E (0.31) TP53KMT2ALMNAALDH1A1KDM4E
SCHEMBL7135299 0.80
SCHEMBL8341823 0.80 ATM (0.37) MAPTKMT2ALMNAHSD17B10ALDH1A1
SCHEMBL6983998 0.78
SCHEMBL8526373 0.77

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
WO-1999014216-A1 SUBSTITUTED 3(-1,2-BENZISOTHIAZOL OR ISOXAZOL-5 YL)-SUBSTITUTED PYRIMIDINE AS HERBICIDES AMERICAN CYANAMID COMPANY (US) 1999-03-25 WO disclosed