SCHEMBL7709134

SCHEMBL7709134

COCOc1cc(I)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KCNN4 O15554 1/20 0.32
SLC6A4 P31645 1/20 0.32
APP P05067 3/20 0.32
ALDH1A1 P00352 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
MAP2K1 Q02750 1/20 0.31
EGFR P00533 1/20 0.31
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 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
SCHEMBL546111 0.81 TDP1 (0.38) HTTTDP1L3MBTL1KCNN4ALDH1A1
SCHEMBL18713508 0.81 HTT (0.49) HTTTDP1L3MBTL1ALDH1A1
SCHEMBL1629547 0.79 PTPN1 (0.35) HTTTDP1APPEGFR
SCHEMBL15255300 0.79 ACHE (0.42) HTTTDP1L3MBTL1KCNN4SLC6A4
SCHEMBL16978298 0.79 APP (0.43) L3MBTL1APPALDH1A1ACHE
SCHEMBL31167307 0.79 FYN (0.37) HTTTDP1L3MBTL1KCNN4ALDH1A1
SCHEMBL1477349 0.78 ALDH1A1 (0.41) FLT1ALDH1A1BCHEACHEMAP2K1
SCHEMBL29509919 0.78 ALDH1A1 (0.41) FLT1ALDH1A1BCHEACHEMAP2K1
SCHEMBL31441812 0.78 ALDH1A1 (0.43) HTTTDP1L3MBTL1SLC6A4APP
SCHEMBL986851 0.78 BACE1 (0.46) APP

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
US-6369279-B1 STYRENE WITH ETHER OR FLUORINE GROUPS FOR POLYMERS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-04-09 US disclosed
US-6333436-B1 Styrene derivatives SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-12-25 US disclosed